N-(1-cyanocyclohexyl)-2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(1-cyanocyclohexyl)-2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(1-cyanocyclohexyl)-2-(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)CN2C=NC3=C(C2=O)C=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O2S/c22-13-21(9-5-2-6-10-21)24-18(26)12-25-14-23-19-16(20(25)27)11-17(28-19)15-7-3-1-4-8-15/h1,3-4,7-8,11,14H,2,5-6,9-10,12H2,(H,24,26)