2-[4-(4-methyl-3-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(4-methyl-3-methylsulfonyl-phenyl)carbonylpiperazin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(4-methyl-3-methylsulfonyl-benzoyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[(4-methyl-3-methylsulfonylphenyl)-oxomethyl]-1-piperazinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(4-methyl-3-methylsulfonylbenzoyl)piperazin-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(3-mesyl-4-methyl-benzoyl)piperazino]acetamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-17-8-9-19(14-20(17)30(2,28)29)22(27)25-12-10-24(11-13-25)16-21(26)23-15-18-6-4-3-5-7-18/h3-9,14H,10-13,15-16H2,1-2H3,(H,23,26)