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

Systemtic Name: N-[3-[(2-hexan-3-yl-1,4-diazepan-1-yl)carbonyl]phenyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[3-[2-(1-ethylbutyl)-1,4-diazepane-1-carbonyl]phenyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[3-[(2-hexan-3-yl-1,4-diazepan-1-yl)-oxomethyl]phenyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[3-(2-hexan-3-yl-1,4-diazepane-1-carbonyl)phenyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[3-[2-(1-ethylbutyl)-1,4-diazepane-1-carbonyl]phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C26H37N3O5S MolecularWeight: 503.65408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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