2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O4S/c26-19(22-17-11-5-6-12-18(17)25(28)29)13-30-21-23-16-10-4-3-9-15(16)20(27)24(21)14-7-1-2-8-14/h3-6,9-12,14H,1-2,7-8,13H2,(H,22,26)