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

Systemtic Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-methyl-benzenesulfonamide Openeye Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N-(5-chloro-2,4-dimethoxy-phenyl)-2-methyl-benzenesulfonamide CAS Name: 5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-N-(5-chloro-2,4-dimethoxyphenyl)-2-methylbenzenesulfonamide IUPAC Name: 5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-N-(5-chloro-2,4-dimethoxyphenyl)-2-methylbenzenesulfonamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-methyl-5-(4-piperonylpiperazine-1-carbonyl)benzenesulfonamide Formula: C28H30ClN3O7S MolecularWeight: 588.0717

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)NC5=CC(=C(C=C5OC)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)S(=O)(=O)NC5=CC(=C(C=C5OC)OC)Cl

InChI

InChI=1S/C28H30ClN3O7S/c1-18-4-6-20(13-27(18)40(34,35)30-22-14-21(29)24(36-2)15-25(22)37-3)28(33)32-10-8-31(9-11-32)16-19-5-7-23-26(12-19)39-17-38-23/h4-7,12-15,30H,8-11,16-17H2,1-3H3