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

Systemtic Name: N-(2-cyanoethyl)-N-methyl-2-[4-oxidanylidene-3-(phenylmethyl)thieno[3,2-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methyl-acetamide CAS Name: N-(2-cyanoethyl)-N-methyl-2-[[4-oxo-3-(phenylmethyl)-2-thieno[3,2-d]pyrimidinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(2-cyanoethyl)-N-methylacetamide Traditional Name: 2-[(3-benzyl-4-keto-thieno[3,2-d]pyrimidin-2-yl)thio]-N-(2-cyanoethyl)-N-methyl-acetamide Formula: C19H18N4O2S2 MolecularWeight: 398.50182

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)SC=C2

Isomeric SMILES

CN(CCC#N)C(=O)CSC1=NC2=C(C(=O)N1CC3=CC=CC=C3)SC=C2

InChI

InChI=1S/C19H18N4O2S2/c1-22(10-5-9-20)16(24)13-27-19-21-15-8-11-26-17(15)18(25)23(19)12-14-6-3-2-4-7-14/h2-4,6-8,11H,5,10,12-13H2,1H3