5-bromanyl-2-methoxy-N-[3-[(4-propyl-1,4-diazepan-1-yl)carbonyl]phenyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[3-[(4-propyl-1,4-diazepan-1-yl)carbonyl]phenyl]benzenesulfonamide Openeye Name: 5-bromo-2-methoxy-N-[3-(4-propyl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[3-[oxo-(4-propyl-1,4-diazepan-1-yl)methyl]phenyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methoxy-N-[3-(4-propyl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 5-bromo-2-methoxy-N-[3-(4-propyl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Formula: C22H28BrN3O4S MolecularWeight: 510.44442

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C22H28BrN3O4S/c1-3-10-25-11-5-12-26(14-13-25)22(27)17-6-4-7-19(15-17)24-31(28,29)21-16-18(23)8-9-20(21)30-2/h4,6-9,15-16,24H,3,5,10-14H2,1-2H3