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

Systemtic Name: N-aminocarbonyl-2-[3-(2-methylphenyl)-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-carbamoyl-2-[3-(o-tolyl)-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-carbamoyl-2-[[3-(2-methylphenyl)-4-oxo-6-phenyl-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: N-carbamoyl-2-[3-(2-methylphenyl)-4-oxo-6-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-carbamoyl-2-[[4-keto-3-(o-tolyl)-6-phenyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC(=O)NC(=O)N)SC(=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(N=C2SCC(=O)NC(=O)N)SC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H18N4O3S2/c1-13-7-5-6-10-16(13)26-20(28)15-11-17(14-8-3-2-4-9-14)31-19(15)25-22(26)30-12-18(27)24-21(23)29/h2-11H,12H2,1H3,(H3,23,24,27,29)