N-(4-ethylphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(4-ethylphenyl)-2-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 2-benzylsulfanyl-N-(4-ethylphenyl)pyridine-3-carboxamide CAS Name: N-(4-ethylphenyl)-2-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 2-benzylsulfanyl-N-(4-ethylphenyl)pyridine-3-carboxamide Traditional Name: 2-(benzylthio)-N-(4-ethylphenyl)nicotinamide Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2OS/c1-2-16-10-12-18(13-11-16)23-20(24)19-9-6-14-22-21(19)25-15-17-7-4-3-5-8-17/h3-14H,2,15H2,1H3,(H,23,24)