N-[(3-methoxyphenyl)methyl]-4-(2-methylpropyl)-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide

Systemtic Name: N-[(3-methoxyphenyl)methyl]-4-(2-methylpropyl)-N-(3-oxidanylidene-3-piperazin-1-yl-propyl)benzenesulfonamide Openeye Name: 4-isobutyl-N-[(3-methoxyphenyl)methyl]-N-(3-oxo-3-piperazin-1-yl-propyl)benzenesulfonamide CAS Name: N-[(3-methoxyphenyl)methyl]-4-(2-methylpropyl)-N-[3-oxo-3-(1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-4-(2-methylpropyl)-N-(3-oxo-3-piperazin-1-ylpropyl)benzenesulfonamide Traditional Name: 4-isobutyl-N-(3-keto-3-piperazino-propyl)-N-m-anisyl-benzenesulfonamide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)N2CCNCC2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C25H35N3O4S/c1-20(2)17-21-7-9-24(10-8-21)33(30,31)28(19-22-5-4-6-23(18-22)32-3)14-11-25(29)27-15-12-26-13-16-27/h4-10,18,20,26H,11-17,19H2,1-3H3