N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-2-(phenylthio)nicotinamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O2S/c1-16-10-12-17(13-11-16)24-20(26)15-25(2)22(27)19-9-6-14-23-21(19)28-18-7-4-3-5-8-18/h3-14H,15H2,1-2H3,(H,24,26)