N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2,4-bis(oxidanylidene)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2,4-dioxo-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Traditional Name: 2,4-diketo-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-1,5-dihydro-1,5-benzodiazepine-7-sulfonamide Formula: C20H19N5O5S MolecularWeight: 441.46036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CC(=O)N4

InChI

InChI=1S/C20H19N5O5S/c1-12-19(20(28)25(24(12)2)13-6-4-3-5-7-13)23-31(29,30)14-8-9-15-16(10-14)22-18(27)11-17(26)21-15/h3-10,23H,11H2,1-2H3,(H,21,26)(H,22,27)