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

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C21H13ClN4O2S MolecularWeight: 420.87152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)NC4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)NC4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C21H13ClN4O2S/c22-17-8-15(7-6-14(17)9-23)25-18(27)10-26-12-24-20-19(21(26)28)16(11-29-20)13-4-2-1-3-5-13/h1-8,11-12H,10H2,(H,25,27)