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

Systemtic Name: N-[3-[(2-butyl-1,4-diazepan-1-yl)carbonyl]-4-chloranyl-phenyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[3-(2-butyl-1,4-diazepane-1-carbonyl)-4-chloro-phenyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[3-[(2-butyl-1,4-diazepan-1-yl)-oxomethyl]-4-chlorophenyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[3-(2-butyl-1,4-diazepane-1-carbonyl)-4-chlorophenyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[3-(2-butyl-1,4-diazepane-1-carbonyl)-4-chloro-phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C24H32ClN3O5S MolecularWeight: 510.04598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CNCCCN1C(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)OC)Cl

Isomeric SMILES

CCCCC1CNCCCN1C(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)OC)OC)Cl

InChI

InChI=1S/C24H32ClN3O5S/c1-4-5-7-18-16-26-12-6-13-28(18)24(29)20-14-17(8-10-21(20)25)27-34(30,31)19-9-11-22(32-2)23(15-19)33-3/h8-11,14-15,18,26-27H,4-7,12-13,16H2,1-3H3