N-(3-methylphenyl)-2-[2-[[3-(2-methylpyrimidin-4-yl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[2-[[3-(2-methylpyrimidin-4-yl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: 2-[2-[3-(2-methylpyrimidin-4-yl)anilino]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: N-(3-methylphenyl)-2-[[2-[3-(2-methyl-4-pyrimidinyl)anilino]-2-oxoethyl]thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-[2-[3-(2-methylpyrimidin-4-yl)anilino]-2-oxoethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-[3-(2-methylpyrimidin-4-yl)anilino]ethyl]thio]-N-(m-tolyl)acetamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C

InChI

InChI=1S/C22H22N4O2S/c1-15-5-3-7-18(11-15)25-21(27)13-29-14-22(28)26-19-8-4-6-17(12-19)20-9-10-23-16(2)24-20/h3-12H,13-14H2,1-2H3,(H,25,27)(H,26,28)