4-[3-[2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]benzenesulfonamide

Systemtic Name: 4-[3-[2-oxidanylidene-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]benzenesulfonamide Openeye Name: 4-[3-[2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]benzenesulfonamide CAS Name: 4-[3-[2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]benzenesulfonamide IUPAC Name: 4-[3-[2-oxo-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]benzenesulfonamide Traditional Name: 4-[3-[2-keto-8-(trifluoromethyl)-1,3-dihydro-1,5-benzodiazepin-4-yl]phenyl]benzenesulfonamide Formula: C22H16F3N3O3S MolecularWeight: 459.44095

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)NC1=O)C3=CC=CC(=C3)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)C(F)(F)F)NC1=O)C3=CC=CC(=C3)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H16F3N3O3S/c23-22(24,25)16-6-9-18-20(11-16)28-21(29)12-19(27-18)15-3-1-2-14(10-15)13-4-7-17(8-5-13)32(26,30)31/h1-11H,12H2,(H,28,29)(H2,26,30,31)