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

Systemtic Name: 4-methoxy-N-[3-[(2-pentan-2-yl-1,4-diazepan-1-yl)carbonyl]phenyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[3-[2-(1-methylbutyl)-1,4-diazepane-1-carbonyl]phenyl]benzenesulfonamide CAS Name: 4-methoxy-N-[3-[oxo-(2-pentan-2-yl-1,4-diazepan-1-yl)methyl]phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[3-(2-pentan-2-yl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 4-methoxy-N-[3-[2-(1-methylbutyl)-1,4-diazepane-1-carbonyl]phenyl]benzenesulfonamide Formula: C24H33N3O4S MolecularWeight: 459.60152

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1CNCCCN1C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC(C)C1CNCCCN1C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H33N3O4S/c1-4-7-18(2)23-17-25-14-6-15-27(23)24(28)19-8-5-9-20(16-19)26-32(29,30)22-12-10-21(31-3)11-13-22/h5,8-13,16,18,23,25-26H,4,6-7,14-15,17H2,1-3H3