N-(2,6-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(4-methoxyphenyl)sulfonylpiperazino]acetamide Formula: C21H27N3O4S MolecularWeight: 417.52178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H27N3O4S/c1-16-5-4-6-17(2)21(16)22-20(25)15-23-11-13-24(14-12-23)29(26,27)19-9-7-18(28-3)8-10-19/h4-10H,11-15H2,1-3H3,(H,22,25)