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

Systemtic Name: N-(2-cyanoethyl)-2-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-phenyl-acetamide Formula: C18H16N4O2S2 MolecularWeight: 384.47524

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC(=O)N(CCC#N)C3=CC=CC=C3)SC=C2

InChI

InChI=1S/C18H16N4O2S2/c1-21-17(24)14-8-11-25-16(14)20-18(21)26-12-15(23)22(10-5-9-19)13-6-3-2-4-7-13/h2-4,6-8,11H,5,10,12H2,1H3