N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-2-methyl-phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methyl-phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-2-methylphenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-methylphenyl]-4-methylbenzenesulfonamide Traditional Name: 4-methyl-N-[2-methyl-5-(4-piperonylpiperazine-1-carbonyl)phenyl]benzenesulfonamide Formula: C27H29N3O5S MolecularWeight: 507.60126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C

InChI

InChI=1S/C27H29N3O5S/c1-19-3-8-23(9-4-19)36(32,33)28-24-16-22(7-5-20(24)2)27(31)30-13-11-29(12-14-30)17-21-6-10-25-26(15-21)35-18-34-25/h3-10,15-16,28H,11-14,17-18H2,1-2H3