N-(4-methylcyclohexyl)-4-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-methylcyclohexyl)-4-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-(4-methylcyclohexyl)-4-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-4-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-4-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]-N-(4-methylcyclohexyl)-3-nitro-benzenesulfonamide Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=NC(=O)C4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)N(C)CC3=NC(=O)C4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O5S/c1-15-7-9-16(10-8-15)26-34(32,33)17-11-12-20(21(13-17)28(30)31)27(2)14-22-24-19-6-4-3-5-18(19)23(29)25-22/h3-6,11-13,15-16,26H,7-10,14H2,1-2H3,(H,24,25,29)