2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide

Systemtic Name: 2-(3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide Openeye Name: 2-(3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide CAS Name: 2-[(3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 2-(3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-nitrophenyl)propanamide Traditional Name: 2-[(3-cyclohexyl-4-keto-quinazolin-2-yl)thio]-N-(4-nitrophenyl)propionamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3C(=O)N2C4CCCCC4

InChI

InChI=1S/C23H24N4O4S/c1-15(21(28)24-16-11-13-18(14-12-16)27(30)31)32-23-25-20-10-6-5-9-19(20)22(29)26(23)17-7-3-2-4-8-17/h5-6,9-15,17H,2-4,7-8H2,1H3,(H,24,28)