4-(1,3-benzodioxol-5-yl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxidanylidene-2-piperazin-1-yl-ethyl)benzenesulfonamide Openeye Name: 4-(1,3-benzodioxol-5-yl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-yl-ethyl)benzenesulfonamide CAS Name: 4-(1,3-benzodioxol-5-yl)-N-[(2-methoxyphenyl)methyl]-N-[2-oxo-2-(1-piperazinyl)ethyl]benzenesulfonamide IUPAC Name: 4-(1,3-benzodioxol-5-yl)-N-[(2-methoxyphenyl)methyl]-N-(2-oxo-2-piperazin-1-ylethyl)benzenesulfonamide Traditional Name: 4-(1,3-benzodioxol-5-yl)-N-(2-keto-2-piperazino-ethyl)-N-o-anisyl-benzenesulfonamide Formula: C27H29N3O6S MolecularWeight: 523.60066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CN(CC(=O)N2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC=C1CN(CC(=O)N2CCNCC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H29N3O6S/c1-34-24-5-3-2-4-22(24)17-30(18-27(31)29-14-12-28-13-15-29)37(32,33)23-9-6-20(7-10-23)21-8-11-25-26(16-21)36-19-35-25/h2-11,16,28H,12-15,17-19H2,1H3