N-(1-cyanocyclohexyl)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CC3)C4(CCCCC4)C#N

Isomeric SMILES

CN(C(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CC3)C4(CCCCC4)C#N

InChI

InChI=1S/C21H24N4O2S/c1-24(21(14-22)11-5-2-6-12-21)18(26)13-28-20-23-17-8-4-3-7-16(17)19(27)25(20)15-9-10-15/h3-4,7-8,15H,2,5-6,9-13H2,1H3