N-[2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-3-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-3-(phenylmethyl)benzenesulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-3-benzyl-benzenesulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-(4-methyl-1-piperazinyl)ethyl]-3-(phenylmethyl)benzenesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazin-1-yl)ethyl]-3-benzylbenzenesulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(4-methylpiperazino)ethyl]-3-benzyl-benzenesulfonamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(CNS(=O)(=O)C2=CC=CC(=C2)CC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1CCN(CC1)C(CNS(=O)(=O)C2=CC=CC(=C2)CC3=CC=CC=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C27H31N3O4S/c1-29-12-14-30(15-13-29)25(23-10-11-26-27(18-23)34-20-33-26)19-28-35(31,32)24-9-5-8-22(17-24)16-21-6-3-2-4-7-21/h2-11,17-18,25,28H,12-16,19-20H2,1H3