(3S,5R)-5-ethenyl-3-methyl-4-(4-methylphenyl)sulfonyl-1-(phenylmethyl)piperazin-2-one

Systemtic Name: (3S,5R)-5-ethenyl-3-methyl-4-(4-methylphenyl)sulfonyl-1-(phenylmethyl)piperazin-2-one Openeye Name: (3S,5R)-1-benzyl-3-methyl-4-(p-tolylsulfonyl)-5-vinyl-piperazin-2-one CAS Name: (3S,5R)-5-ethenyl-3-methyl-4-(4-methylphenyl)sulfonyl-1-(phenylmethyl)-2-piperazinone IUPAC Name: (3S,5R)-1-benzyl-5-ethenyl-3-methyl-4-(4-methylphenyl)sulfonylpiperazin-2-one Traditional Name: (3S,5R)-1-benzyl-3-methyl-4-tosyl-5-vinyl-piperazin-2-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC(N1S(=O)(=O)C2=CC=C(C=C2)C)C=C)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1C(=O)N(C[C@H](N1S(=O)(=O)C2=CC=C(C=C2)C)C=C)CC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S/c1-4-19-15-22(14-18-8-6-5-7-9-18)21(24)17(3)23(19)27(25,26)20-12-10-16(2)11-13-20/h4-13,17,19H,1,14-15H2,2-3H3/t17-,19+/m0/s1