1-[2-(2-methylpropyl)-4-methylsulfanyl-phenyl]-3-propan-2-ylsulfonyl-piperazine

Systemtic Name: 1-[2-(2-methylpropyl)-4-methylsulfanyl-phenyl]-3-propan-2-ylsulfonyl-piperazine Openeye Name: 1-(2-isobutyl-4-methylsulfanyl-phenyl)-3-isopropylsulfonyl-piperazine CAS Name: 1-[2-(2-methylpropyl)-4-(methylthio)phenyl]-3-propan-2-ylsulfonylpiperazine IUPAC Name: 1-[2-(2-methylpropyl)-4-methylsulfanylphenyl]-3-propan-2-ylsulfonylpiperazine Traditional Name: 1-[2-isobutyl-4-(methylthio)phenyl]-3-isopropylsulfonyl-piperazine Formula: C18H30N2O2S2 MolecularWeight: 370.573

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CC(C)CC1=C(C=CC(=C1)SC)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C18H30N2O2S2/c1-13(2)10-15-11-16(23-5)6-7-17(15)20-9-8-19-18(12-20)24(21,22)14(3)4/h6-7,11,13-14,18-19H,8-10,12H2,1-5H3