N,N-diethyl-4-[(7-fluoranyl-2-oxidanylidene-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-4-yl)carbonyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[(7-fluoranyl-2-oxidanylidene-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-4-yl)carbonyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-(7-fluoro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbonyl)benzenesulfonamide CAS Name: N,N-diethyl-4-[(7-fluoro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-4-yl)-oxomethyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-(7-fluoro-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbonyl)benzenesulfonamide Traditional Name: N,N-diethyl-4-(7-fluoro-2-keto-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbonyl)benzenesulfonamide Formula: C26H26FN3O4S MolecularWeight: 495.565743

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)F

InChI

InChI=1S/C26H26FN3O4S/c1-3-29(4-2)35(33,34)21-13-10-19(11-14-21)26(32)30-17-24(31)28-23-15-12-20(27)16-22(23)25(30)18-8-6-5-7-9-18/h5-16,25H,3-4,17H2,1-2H3,(H,28,31)