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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-(4-propanoylpiperazin-1-yl)benzenesulfonamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-(4-propanoylpiperazin-1-yl)benzenesulfonamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-[4-(1-oxopropyl)-1-piperazinyl]benzenesulfonamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-N-methyl-3-(4-propanoylpiperazin-1-yl)benzenesulfonamide Traditional Name: N-homoveratryl-4-methoxy-N-methyl-3-(4-propionylpiperazino)benzenesulfonamide Formula: C25H35N3O6S MolecularWeight: 505.6269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35N3O6S/c1-6-25(29)28-15-13-27(14-16-28)21-18-20(8-10-22(21)32-3)35(30,31)26(2)12-11-19-7-9-23(33-4)24(17-19)34-5/h7-10,17-18H,6,11-16H2,1-5H3