N-[3-[bis(2-methylpropyl)amino]propyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: N-[3-[bis(2-methylpropyl)amino]propyl]-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: N-[3-(diisobutylamino)propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: N-[3-[bis(2-methylpropyl)amino]propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: N-[3-[bis(2-methylpropyl)amino]propyl]-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: N-[3-(diisobutylamino)propyl]-2-keto-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCCNS(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2)CC(C)C

Isomeric SMILES

CC(C)CN(CCCNS(=O)(=O)C1=CC2=C(C=C1)NC(=O)CCC2)CC(C)C

InChI

InChI=1S/C21H35N3O3S/c1-16(2)14-24(15-17(3)4)12-6-11-22-28(26,27)19-9-10-20-18(13-19)7-5-8-21(25)23-20/h9-10,13,16-17,22H,5-8,11-12,14-15H2,1-4H3,(H,23,25)