4-methyl-6-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-(phenylcarbamoyl)pyridin-2-olate

Systemtic Name: 4-methyl-6-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-5-(phenylcarbamoyl)pyridin-2-olate Openeye Name: 4-methyl-6-[2-(2-methylanilino)-2-oxo-ethyl]sulfanyl-5-(phenylcarbamoyl)pyridin-2-olate CAS Name: 5-[anilino(oxo)methyl]-4-methyl-6-[[2-(2-methylanilino)-2-oxoethyl]thio]-2-pyridinolate IUPAC Name: 4-methyl-6-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-5-(phenylcarbamoyl)pyridin-2-olate Traditional Name: 6-[[2-keto-2-(o-toluidino)ethyl]thio]-4-methyl-5-(phenylcarbamoyl)pyridin-2-olate Formula: C22H20N3O3S- MolecularWeight: 406.4775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=C(C(=CC(=N2)[O-])C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=C(C(=CC(=N2)[O-])C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3S/c1-14-8-6-7-11-17(14)24-19(27)13-29-22-20(15(2)12-18(26)25-22)21(28)23-16-9-4-3-5-10-16/h3-12H,13H2,1-2H3,(H,23,28)(H,24,27)(H,25,26)/p-1