1-(2-ethyl-4-methylsulfanyl-phenyl)-3-propan-2-ylsulfonyl-piperazine

Systemtic Name: 1-(2-ethyl-4-methylsulfanyl-phenyl)-3-propan-2-ylsulfonyl-piperazine Openeye Name: 1-(2-ethyl-4-methylsulfanyl-phenyl)-3-isopropylsulfonyl-piperazine CAS Name: 1-[2-ethyl-4-(methylthio)phenyl]-3-propan-2-ylsulfonylpiperazine IUPAC Name: 1-(2-ethyl-4-methylsulfanylphenyl)-3-propan-2-ylsulfonylpiperazine Traditional Name: 1-[2-ethyl-4-(methylthio)phenyl]-3-isopropylsulfonyl-piperazine Formula: C16H26N2O2S2 MolecularWeight: 342.51984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C16H26N2O2S2/c1-5-13-10-14(21-4)6-7-15(13)18-9-8-17-16(11-18)22(19,20)12(2)3/h6-7,10,12,16-17H,5,8-9,11H2,1-4H3