4-(3,4-dimethoxyphenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(p-tolylmethyl)piperazine-1-carboxamide CAS Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-[(4-methylphenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-[(4-methylphenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(4-methylbenzyl)piperazine-1-carboxamide Formula: C21H27N3O5S MolecularWeight: 433.52118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H27N3O5S/c1-16-4-6-17(7-5-16)15-22-21(25)23-10-12-24(13-11-23)30(26,27)18-8-9-19(28-2)20(14-18)29-3/h4-9,14H,10-13,15H2,1-3H3,(H,22,25)