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

Systemtic Name: 1-(4-methylsulfanyl-2-propyl-phenyl)-3-propan-2-ylsulfonyl-piperazine Openeye Name: 3-isopropylsulfonyl-1-(4-methylsulfanyl-2-propyl-phenyl)piperazine CAS Name: 1-[4-(methylthio)-2-propylphenyl]-3-propan-2-ylsulfonylpiperazine IUPAC Name: 1-(4-methylsulfanyl-2-propylphenyl)-3-propan-2-ylsulfonylpiperazine Traditional Name: 3-isopropylsulfonyl-1-[4-(methylthio)-2-propyl-phenyl]piperazine Formula: C17H28N2O2S2 MolecularWeight: 356.54642

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CCCC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C17H28N2O2S2/c1-5-6-14-11-15(22-4)7-8-16(14)19-10-9-18-17(12-19)23(20,21)13(2)3/h7-8,11,13,17-18H,5-6,9-10,12H2,1-4H3