(2S,3R)-2-ethyl-6-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-piperazine

Systemtic Name: (2S,3R)-2-ethyl-6-methyl-1-(4-methylphenyl)sulfonyl-3-phenyl-piperazine Openeye Name: (2S,3R)-2-ethyl-6-methyl-3-phenyl-1-(p-tolylsulfonyl)piperazine CAS Name: (2S,3R)-2-ethyl-6-methyl-1-(4-methylphenyl)sulfonyl-3-phenylpiperazine IUPAC Name: (2S,3R)-2-ethyl-6-methyl-1-(4-methylphenyl)sulfonyl-3-phenylpiperazine Traditional Name: (2S,3R)-2-ethyl-6-methyl-3-phenyl-1-tosyl-piperazine Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(NCC(N1S(=O)(=O)C2=CC=C(C=C2)C)C)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O2S/c1-4-19-20(17-8-6-5-7-9-17)21-14-16(3)22(19)25(23,24)18-12-10-15(2)11-13-18/h5-13,16,19-21H,4,14H2,1-3H3/t16?,19-,20+/m0/s1