3-nitro-4-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 3-nitro-4-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-propan-2-yl-benzenesulfonamide Openeye Name: N-isopropyl-3-nitro-4-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-benzenesulfonamide CAS Name: 3-nitro-4-[(4-oxo-3-propyl-2-quinazolinyl)thio]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 3-nitro-4-(4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-propan-2-ylbenzenesulfonamide Traditional Name: N-isopropyl-4-[(4-keto-3-propyl-quinazolin-2-yl)thio]-3-nitro-benzenesulfonamide Formula: C20H22N4O5S2 MolecularWeight: 462.54248

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5S2/c1-4-11-23-19(25)15-7-5-6-8-16(15)21-20(23)30-18-10-9-14(12-17(18)24(26)27)31(28,29)22-13(2)3/h5-10,12-13,22H,4,11H2,1-3H3