N-(2,5-dimethoxyphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-(2,5-dimethoxyphenyl)pyridine-3-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-(2,5-dimethoxyphenyl)pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-(2,5-dimethoxyphenyl)nicotinamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-25-16-10-11-19(26-2)18(13-16)23-20(24)17-9-6-12-22-21(17)27-14-15-7-4-3-5-8-15/h3-13H,14H2,1-2H3,(H,23,24)