N-(cyanomethyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-phenyl-ethanamide

Systemtic Name: N-(cyanomethyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-phenyl-ethanamide Openeye Name: N-(cyanomethyl)-2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-phenyl-acetamide CAS Name: N-(cyanomethyl)-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)-N-phenylacetamide IUPAC Name: N-(cyanomethyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)-N-phenylacetamide Traditional Name: N-(cyanomethyl)-2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-N-phenyl-acetamide Formula: C22H16N4O2S MolecularWeight: 400.45304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)N(CC#N)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)N(CC#N)C4=CC=CC=C4

InChI

InChI=1S/C22H16N4O2S/c23-11-12-26(17-9-5-2-6-10-17)19(27)13-25-15-24-21-20(22(25)28)18(14-29-21)16-7-3-1-4-8-16/h1-10,14-15H,12-13H2