2-oxidanylidene-N-[2-(4-sulfamoylphenyl)ethyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide

Systemtic Name: 2-oxidanylidene-N-[2-(4-sulfamoylphenyl)ethyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Openeye Name: 2-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide CAS Name: 2-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide IUPAC Name: 2-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Traditional Name: 2-keto-N-[2-(4-sulfamoylphenyl)ethyl]-1,3,4,5-tetrahydro-1-benzazepine-7-sulfonamide Formula: C18H21N3O5S2 MolecularWeight: 423.50644

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N)NC(=O)C1

InChI

InChI=1S/C18H21N3O5S2/c19-27(23,24)15-6-4-13(5-7-15)10-11-20-28(25,26)16-8-9-17-14(12-16)2-1-3-18(22)21-17/h4-9,12,20H,1-3,10-11H2,(H,21,22)(H2,19,23,24)