N-[(5-chloranyl-2-methylsulfanyl-phenyl)methyl]-2-phenyl-piperidin-3-amine dihydrochloride

Systemtic Name: N-[(5-chloranyl-2-methylsulfanyl-phenyl)methyl]-2-phenyl-piperidin-3-amine dihydrochloride Openeye Name: N-[(5-chloro-2-methylsulfanyl-phenyl)methyl]-2-phenyl-piperidin-3-amine dihydrochloride CAS Name: N-[[5-chloro-2-(methylthio)phenyl]methyl]-2-phenyl-3-piperidinamine dihydrochloride IUPAC Name: N-[(5-chloro-2-methylsulfanylphenyl)methyl]-2-phenylpiperidin-3-amine dihydrochloride Traditional Name: [5-chloro-2-(methylthio)benzyl]-(2-phenyl-3-piperidyl)amine dihydrochloride Formula: C19H25Cl3N2S MolecularWeight: 419.8392

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)Cl)CNC2CCCNC2C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CSC1=C(C=C(C=C1)Cl)CNC2CCCNC2C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C19H23ClN2S.2ClH/c1-23-18-10-9-16(20)12-15(18)13-22-17-8-5-11-21-19(17)14-6-3-2-4-7-14;;/h2-4,6-7,9-10,12,17,19,21-22H,5,8,11,13H2,1H3;2*1H