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

Systemtic Name: 3,4-dimethoxy-N-[2-methyl-3-[(2-pentan-2-yl-1,4-diazepan-1-yl)carbonyl]phenyl]benzenesulfonamide Openeye Name: 3,4-dimethoxy-N-[2-methyl-3-[2-(1-methylbutyl)-1,4-diazepane-1-carbonyl]phenyl]benzenesulfonamide CAS Name: 3,4-dimethoxy-N-[2-methyl-3-[oxo-(2-pentan-2-yl-1,4-diazepan-1-yl)methyl]phenyl]benzenesulfonamide IUPAC Name: 3,4-dimethoxy-N-[2-methyl-3-(2-pentan-2-yl-1,4-diazepane-1-carbonyl)phenyl]benzenesulfonamide Traditional Name: 3,4-dimethoxy-N-[2-methyl-3-[2-(1-methylbutyl)-1,4-diazepane-1-carbonyl]phenyl]benzenesulfonamide Formula: C26H37N3O5S MolecularWeight: 503.65408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37N3O5S/c1-6-9-18(2)23-17-27-14-8-15-29(23)26(30)21-10-7-11-22(19(21)3)28-35(31,32)20-12-13-24(33-4)25(16-20)34-5/h7,10-13,16,18,23,27-28H,6,8-9,14-15,17H2,1-5H3