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

Systemtic Name: 4-[[(5R)-7-bromanyl-2-oxidanylidene-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-4-yl]carbonyl]-N,N-dipropyl-benzenesulfonamide Openeye Name: 4-[(5R)-7-bromo-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbonyl]-N,N-dipropyl-benzenesulfonamide CAS Name: 4-[[(5R)-7-bromo-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-4-yl]-oxomethyl]-N,N-dipropylbenzenesulfonamide IUPAC Name: 4-[(5R)-7-bromo-2-oxo-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbonyl]-N,N-dipropylbenzenesulfonamide Traditional Name: 4-[(5R)-7-bromo-2-keto-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepine-4-carbonyl]-N,N-dipropyl-benzenesulfonamide Formula: C28H30BrN3O4S MolecularWeight: 584.5245

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)Br

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC(=O)NC3=C([C@H]2C4=CC=CC=C4)C=C(C=C3)Br

InChI

InChI=1S/C28H30BrN3O4S/c1-3-16-31(17-4-2)37(35,36)23-13-10-21(11-14-23)28(34)32-19-26(33)30-25-15-12-22(29)18-24(25)27(32)20-8-6-5-7-9-20/h5-15,18,27H,3-4,16-17,19H2,1-2H3,(H,30,33)/t27-/m1/s1