2-[5,6-dimethyl-3-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-[5,6-dimethyl-3-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[5,6-dimethyl-3-(m-tolyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[5,6-dimethyl-3-(3-methylphenyl)-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]-N-phenylacetamide IUPAC Name: 2-[5,6-dimethyl-3-(3-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-phenylacetamide Traditional Name: 2-[[4-keto-5,6-dimethyl-3-(m-tolyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-phenyl-acetamide Formula: C23H21N3O2S2 MolecularWeight: 435.56174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC=C4)SC(=C3C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC=C4)SC(=C3C)C

InChI

InChI=1S/C23H21N3O2S2/c1-14-8-7-11-18(12-14)26-22(28)20-15(2)16(3)30-21(20)25-23(26)29-13-19(27)24-17-9-5-4-6-10-17/h4-12H,13H2,1-3H3,(H,24,27)