1-[4-methylsulfanyl-2-(phenylmethyl)phenyl]-3-(phenylsulfonyl)piperazine

Systemtic Name: 1-[4-methylsulfanyl-2-(phenylmethyl)phenyl]-3-(phenylsulfonyl)piperazine Openeye Name: 3-(benzenesulfonyl)-1-(2-benzyl-4-methylsulfanyl-phenyl)piperazine CAS Name: 3-(benzenesulfonyl)-1-[4-(methylthio)-2-(phenylmethyl)phenyl]piperazine IUPAC Name: 3-(benzenesulfonyl)-1-(2-benzyl-4-methylsulfanylphenyl)piperazine Traditional Name: 1-[2-benzyl-4-(methylthio)phenyl]-3-besyl-piperazine Formula: C24H26N2O2S2 MolecularWeight: 438.60544

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CSC1=CC(=C(C=C1)N2CCNC(C2)S(=O)(=O)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O2S2/c1-29-21-12-13-23(20(17-21)16-19-8-4-2-5-9-19)26-15-14-25-24(18-26)30(27,28)22-10-6-3-7-11-22/h2-13,17,24-25H,14-16,18H2,1H3