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

Systemtic Name: 2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(2,4-dimethylphenyl)sulfonyl-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(2,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(2,4-dimethylphenyl)sulfonylpiperazino]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NCC3=CC=CC=C3)C

InChI

InChI=1S/C21H27N3O3S/c1-17-8-9-20(18(2)14-17)28(26,27)24-12-10-23(11-13-24)16-21(25)22-15-19-6-4-3-5-7-19/h3-9,14H,10-13,15-16H2,1-2H3,(H,22,25)