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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C25H27N3O2S/c1-5-19-9-11-20(12-10-19)28-24(30)23-17(3)14-18(4)26-25(23)31-15-22(29)27-21-8-6-7-16(2)13-21/h6-14H,5,15H2,1-4H3,(H,27,29)(H,28,30)