N-[3-(1,4-diazepan-1-ylcarbonyl)phenyl]benzenesulfonamide

Systemtic Name: N-[3-(1,4-diazepan-1-ylcarbonyl)phenyl]benzenesulfonamide Openeye Name: N-[3-(1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide CAS Name: N-[3-[1,4-diazepan-1-yl(oxo)methyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-(1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: N-[3-(1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H21N3O3S/c22-18(21-12-5-10-19-11-13-21)15-6-4-7-16(14-15)20-25(23,24)17-8-2-1-3-9-17/h1-4,6-9,14,19-20H,5,10-13H2