N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-4-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-4-methoxy-N-methyl-benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-4-methoxy-N-methyl-benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-ethyl-1-oxobutyl)-1-piperazinyl]-4-methoxy-N-methylbenzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[4-(2-ethylbutanoyl)piperazin-1-yl]-4-methoxy-N-methylbenzenesulfonamide Traditional Name: 3-[4-(2-ethylbutanoyl)piperazino]-N-homoveratryl-4-methoxy-N-methyl-benzenesulfonamide Formula: C28H41N3O6S MolecularWeight: 547.70664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)N(C)CCC3=CC(=C(C=C3)OC)OC)OC

Isomeric SMILES

CCC(CC)C(=O)N1CCN(CC1)C2=C(C=CC(=C2)S(=O)(=O)N(C)CCC3=CC(=C(C=C3)OC)OC)OC

InChI

InChI=1S/C28H41N3O6S/c1-7-22(8-2)28(32)31-17-15-30(16-18-31)24-20-23(10-12-25(24)35-4)38(33,34)29(3)14-13-21-9-11-26(36-5)27(19-21)37-6/h9-12,19-20,22H,7-8,13-18H2,1-6H3