Compound Name

SMILES String

OCCCNc1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1

OCCCCNc1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1

CN(C)CCNc1cncc(c1)-c1cncc(Nc2cccc(Cl)c2)n1

Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCc3cccnc3)c2)c1

Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCn3cccn3)c2)c1

Clc1cccc(Nc2cncc(n2)-c2cncc(NCCCn3cncn3)c2)c1

c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F

Cc1ccc(F)c(C(=O)n2nc(Nc3ccc(cc3)S(N)(=O)=O)nc2N)c1F

Cc1ccsc1C(=O)n1nc(Nc2ccc(cc2)S(N)(=O)=O)nc1N

c1cc(c(c(c1)F)NC(=S)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F

CCn1c(=O)sn(C)c1=O

CCn1sc(=O)n(CC)c1=O

CCCn1sc(=O)n(CC)c1=O

CCn1c(=O)sn(C(C)C)c1=O

CCn1c(=O)sn(C2CCCCC2)c1=O

CCCCn1c(=O)sn(CC)c1=O

Cn1sc(=O)n(C2CCCCC2)c1=O

CN1C(=O)N(C(=O)S1)Cc2ccccc2

CCn1sc(=O)n(Cc2ccccc2)c1=O

O=c1sn(Cc2ccccc2)c(=O)n1Cc1ccccc1

Cn1sc(=O)n(-c2ccccc2)c1=O

Cn1sc(=O)n(-c2ccc(Br)cc2)c1=O

Cn1sc(=O)n(-c2cccc(Br)c2)c1=O

Cn1sc(=O)n(-c2ccccc2Br)c1=O |(-2.2,-2.25,;-1.3,-1,;.25,-1,;.72,.46,;2.05,1.23,;-.52,1.37,;-.52,2.91,;-1.86,3.68,;-1.86,5.22,;-.52,5.99,;.81,5.22,;.81,3.68,;2.14,2.91,;-1.77,.46,;-3.24,.94,)|

Cn1sc(=O)n(-c2ccc(Cl)cc2)c1=O

Cn1sc(=O)n(-c2ccc(F)cc2)c1=O

Cn1sc(=O)n(-c2ccc(cc2)C(F)(F)F)c1=O

Cc1ccc(cc1)-n1c(=O)sn(C)c1=O

COc1ccc(cc1)-n1c(=O)sn(C)c1=O

Cn1sc(=O)n(-c2cccc3ccccc23)c1=O |(-2.2,-2.25,;-1.3,-1,;.25,-1,;.72,.46,;2.05,1.23,;-.52,1.37,;-.52,2.91,;-1.86,3.68,;-1.86,5.22,;-.52,5.99,;.75,5.22,;2.08,5.99,;3.42,5.22,;3.42,3.68,;2.08,2.91,;.75,3.68,;-1.77,.46,;-3.24,.94,)|

CCn1sc(=O)n(CC)c1=S

O=c1sn(-c2ccccc2)c(=S)n1-c1ccccc1

O=c1sn(Cc2ccccc2)c(=S)n1Cc1ccccc1

CCn1sc(=O)n(Cc2ccccc2)c1=S

CCn1c(=S)n(C)s\c1=N/c1cccnc1

CCNC(=O)\N=c1/sn(CC)c(=O)n1-c1ccccc1

CCn1sc(=N)n(-c2ccccc2)c1=O

CCOC(=O)\N=c1/sn(C(=O)OCC)c(=S)n1-c1ccccc1

C1=CC(=O)NC1=O

CN1C(=O)C=CC1=O |c:4|

O=C1C=CC(=O)N1Cc1ccccc1 |c:2|

CCOC(=O)CN1C(=O)C=CC1=O |c:9|

COc1ccc(CN2C(=O)C=CC2=O)cc1 |c:10|

O=C1C=CC(=O)N1CCc1ccccc1 |c:2|

COc1ccc(CCN2C(=O)C=CC2=O)cc1 |c:11|

O=C1C=CC(=O)N1CCCc1ccccc1 |c:2|

O=C1C=CC(=O)N1CCCCCc1ccccc1 |c:2|

O=C1CC(=O)C=C1 |c:5|

O=C1OC(=O)C=C1 |c:5|

C1CC(=O)CC1=O

O=C1CCC(=O)N1

O=C1CCC(=O)N1Cc1ccccc1

O=C1CCCN1Cc1ccccc1

C(N1CC=CC1)c1ccccc1 |c:3|

Oc1csc(S)n1

Cn1c(O)csc1=S

OC(=O)Cn1c(O)csc1=S

Nn1c(O)csc1=S

Oc1csc(=O)[nH]1

Oc1csc(=S)n1Cc1ccccc1

Oc1csc(=S)n1CCc1ccccc1

Oc1csc(=S)n1CC(=O)c1ccccc1

Oc1csc(=O)n1Cc1ccccc1

COc1ccc(Cn2c(O)csc2=S)cc1

COc1ccc(CCn2c(O)csc2=S)cc1

Cn1c(=O)ssc1=O

O=c1ssc(=O)n1-c1ccccc1

O=c1ssc(=O)n1Cc1ccccc1

O=c1[nH][nH]c(=O)n1-c1ccccc1

Cn1n(C)c(=O)n(-c2ccccc2)c1=O

O=C(c1ccccc1)n1n(C(=O)c2ccccc2)c(=O)n(-c2ccccc2)c1=O

O=C(Cn1n(CC(=O)c2ccccc2)c(=O)n(-c2ccccc2)c1=O)c1ccccc1

O=C1N=NC(=O)N1c1ccccc1 |c:2|

Oc1c[nH]c(=O)[nH]1

Oc1c[nH]c(=O)n1Cc1ccccc1

CCn1sc(=O)n(-c2ccc(cc2)N(=O)=O)c1=O

CCn1sc(=O)n(-c2ccccc2)c1=O

CCOC(=O)Cn1c(=O)sn(C)c1=O

ClCC(=O)c1cc(Cl)c(Cl)s1

ClCC(=O)c1cc(Br)cs1

ClCC(=O)c1cscc1Cl

ClCC(=O)c1c(Br)sc(Br)c1Br

ClCC(=O)c1c(Cl)c(Cl)sc1Br

ClCC(=O)c1cccs1

ClCC(=O)c1csc(c1)C(=O)CCl

Cc1ccc(s1)C(=O)CCl

Cc1sc(cc1C(=O)CCl)C(=O)CCl

Cc1cc(C(=O)CCl)c(C)s1

Cc1ccsc1C(=O)CCl

Cc1csc(c1)C(=O)CCl

Cc1c(csc1C(=O)CCl)C(=O)CCl

ClCC(=O)c1ccc(Cl)s1

ClCC(=O)c1ccc(Br)s1

ClCC(=O)c1scc(Br)c1Br

ClCC(=O)c1cc(Br)c(Br)s1

ClCC(=O)c1cc(Cl)sc1Cl

CC(=O)c1ccc(s1)C(=O)CCl

CC(=O)c1csc(c1)C(=O)CCl

ClCC(=O)c1ccccc1

ClCC(=O)c1ccc(Cl)cc1

c1ccc(cc1)C(=O)CBr

c1cc(ccc1C(=O)CBr)Br

Clc1ccc(cc1)C(=O)CBr

Cc1ccc(cc1)C(=O)CBr

COc1ccc(cc1)C(=O)CBr

BrCC(=O)c1ccc(cc1)-c1ccccc1

BrCC(=O)c1ccc(cc1)N(=O)=O