4-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-(phenylmethyl)benzenesulfonamide Openeye Name: 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxo-propyl]-N-benzyl-benzenesulfonamide CAS Name: 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-oxopropyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: 4-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxopropyl]-N-benzylbenzenesulfonamide Traditional Name: N-benzyl-4-[3-keto-3-(4-piperonylpiperazino)propyl]benzenesulfonamide Formula: C28H31N3O5S MolecularWeight: 521.62784

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCC4=CC=C(C=C4)S(=O)(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCC4=CC=C(C=C4)S(=O)(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H31N3O5S/c32-28(31-16-14-30(15-17-31)20-24-8-12-26-27(18-24)36-21-35-26)13-9-22-6-10-25(11-7-22)37(33,34)29-19-23-4-2-1-3-5-23/h1-8,10-12,18,29H,9,13-17,19-21H2