4,6-dimethyl-N-(3-methylphenyl)-2-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: 4,6-dimethyl-N-(3-methylphenyl)-2-[2-oxidanylidene-2-(1-phenylethylamino)ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: 4,6-dimethyl-N-(m-tolyl)-2-[2-oxo-2-(1-phenylethylamino)ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: 4,6-dimethyl-N-(3-methylphenyl)-2-[[2-oxo-2-(1-phenylethylamino)ethyl]thio]-3-pyridinecarboxamide IUPAC Name: 4,6-dimethyl-N-(3-methylphenyl)-2-[2-oxo-2-(1-phenylethylamino)ethyl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[[2-keto-2-(1-phenylethylamino)ethyl]thio]-4,6-dimethyl-N-(m-tolyl)nicotinamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C25H27N3O2S/c1-16-9-8-12-21(13-16)28-24(30)23-17(2)14-18(3)26-25(23)31-15-22(29)27-19(4)20-10-6-5-7-11-20/h5-14,19H,15H2,1-4H3,(H,27,29)(H,28,30)