N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-chloranyl-2,5-dimethoxy-phenyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-(4-chloro-2,5-dimethoxy-phenyl)pyridine-3-carboxamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-(4-chloro-2,5-dimethoxyphenyl)pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-(4-chloro-2,5-dimethoxy-phenyl)nicotinamide Formula: C21H19ClN2O3S MolecularWeight: 414.90516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3)OC)Cl

InChI

InChI=1S/C21H19ClN2O3S/c1-26-18-12-17(19(27-2)11-16(18)22)24-20(25)15-9-6-10-23-21(15)28-13-14-7-4-3-5-8-14/h3-12H,13H2,1-2H3,(H,24,25)