N-(1-cyanocyclohexyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(1-cyanocyclohexyl)-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(1-cyanocyclohexyl)-2-(4-keto-5-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(=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=CC=C4

InChI

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