N-[(2-cyanophenyl)carbamoyl]-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2-cyanophenyl)carbamoyl]-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(2-cyanophenyl)carbamoyl]-2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(2-cyanoanilino)-oxomethyl]-2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(2-cyanophenyl)carbamoyl]-2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[(2-cyanophenyl)carbamoyl]-2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C17H13N5O3S2 MolecularWeight: 399.44682

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC(=O)NC(=O)NC3=CC=CC=C3C#N)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC(=O)NC(=O)NC3=CC=CC=C3C#N)SC=C2

InChI

InChI=1S/C17H13N5O3S2/c1-22-15(24)11-6-7-26-14(11)21-17(22)27-9-13(23)20-16(25)19-12-5-3-2-4-10(12)8-18/h2-7H,9H2,1H3,(H2,19,20,23,25)