3-cyclopentyl-N-(2-methylcyclohexyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-cyclopentyl-N-(2-methylcyclohexyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-cyclopentyl-N-(2-methylcyclohexyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-cyclopentyl-N-(2-methylcyclohexyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-cyclopentyl-N-(2-methylcyclohexyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-cyclopentyl-4-keto-N-(2-methylcyclohexyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4CCCC4

Isomeric SMILES

CC1CCCCC1NC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4CCCC4

InChI

InChI=1S/C21H27N3O2S/c1-13-6-2-5-9-17(13)22-19(25)14-10-11-16-18(12-14)23-21(27)24(20(16)26)15-7-3-4-8-15/h10-13,15,17H,2-9H2,1H3,(H,22,25)(H,23,27)