N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-4-(quinolin-8-ylsulfanylmethyl)benzamide

Systemtic Name: N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-4-(quinolin-8-ylsulfanylmethyl)benzamide Openeye Name: N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-4-(8-quinolylsulfanylmethyl)benzamide CAS Name: N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-4-[(8-quinolinylthio)methyl]benzamide IUPAC Name: N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-4-(quinolin-8-ylsulfanylmethyl)benzamide Traditional Name: N-[(E)-1-(3,4-dimethoxyphenyl)ethylideneamino]-4-[(8-quinolylthio)methyl]benzamide Formula: C27H25N3O3S MolecularWeight: 471.5707

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=C(C=C1)CSC2=CC=CC3=C2N=CC=C3)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=C(C=C1)CSC2=CC=CC3=C2N=CC=C3)/C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H25N3O3S/c1-18(22-13-14-23(32-2)24(16-22)33-3)29-30-27(31)21-11-9-19(10-12-21)17-34-25-8-4-6-20-7-5-15-28-26(20)25/h4-16H,17H2,1-3H3,(H,30,31)/b29-18+