N-(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-phenyl-ethanamide

Systemtic Name: N-(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: N-(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-phenyl-acetamide CAS Name: N-(2-cyanoethyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-N-phenylacetamide IUPAC Name: N-(2-cyanoethyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-phenylacetamide Traditional Name: N-(2-cyanoethyl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-N-phenyl-acetamide Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N(CCC#N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N(CCC#N)C3=CC=CC=C3)C

InChI

InChI=1S/C19H18N4OS2/c1-13-14(2)26-19-17(13)18(21-12-22-19)25-11-16(24)23(10-6-9-20)15-7-4-3-5-8-15/h3-5,7-8,12H,6,10-11H2,1-2H3