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1-[3-[(3-cyano-6-methoxy-quinolin-1-ium-2-yl)amino]propyl]-3-(2-methoxyethyl)thiourea
1-[3-[(3-cyano-6-methoxy-quinolin-1-ium-2-yl)amino]propyl]-3-(2-methoxyethyl)thiourea
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Descriptors Computed from Structure
Canonical SMILES:
COCCNC(=S)NCCCNC1=[NH+]C2=C(C=C(C=C2)OC)C=C1C#N
Isomeric SMILES
COCCNC(=S)NCCCNC1=[NH+]C2=C(C=C(C=C2)OC)C=C1C#N
InChI
InChI=1S/C18H23N5O2S/c1-24-9-8-22-18(26)21-7-3-6-20-17-14(12-19)10-13-11-15(25-2)4-5-16(13)23-17/h4-5,10-11H,3,6-9H2,1-2H3,(H,20,23)(H2,21,22,26)/p+1
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- 1-[2-[(3-cyano-6,8-dimethyl-quinolin-1-ium-2-yl)amino]ethyl]-3-(3-methoxypropyl)thiourea
