2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methoxy-2-nitro-phenyl)ethanamide

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methoxy-2-nitro-phenyl)ethanamide Openeye Name: 2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-methoxy-2-nitro-phenyl)acetamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-(4-methoxy-2-nitrophenyl)acetamide IUPAC Name: 2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-methoxy-2-nitrophenyl)acetamide Traditional Name: 2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-(4-methoxy-2-nitro-phenyl)acetamide Formula: C20H18N4O5S MolecularWeight: 426.44572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5S/c1-29-13-8-9-16(17(10-13)24(27)28)21-18(25)11-30-20-22-15-5-3-2-4-14(15)19(26)23(20)12-6-7-12/h2-5,8-10,12H,6-7,11H2,1H3,(H,21,25)