[3-(hydroxymethyl)-3-(3-phenylpropyl)piperidin-1-yl]-(4-methylsulfanylphenyl)methanone

Systemtic Name: [3-(hydroxymethyl)-3-(3-phenylpropyl)piperidin-1-yl]-(4-methylsulfanylphenyl)methanone Openeye Name: [3-(hydroxymethyl)-3-(3-phenylpropyl)-1-piperidyl]-(4-methylsulfanylphenyl)methanone CAS Name: [3-(hydroxymethyl)-3-(3-phenylpropyl)-1-piperidinyl]-[4-(methylthio)phenyl]methanone IUPAC Name: [3-(hydroxymethyl)-3-(3-phenylpropyl)piperidin-1-yl]-(4-methylsulfanylphenyl)methanone Traditional Name: [3-methylol-3-(3-phenylpropyl)piperidino]-[4-(methylthio)phenyl]methanone Formula: C23H29NO2S MolecularWeight: 383.54686

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)N2CCCC(C2)(CCCC3=CC=CC=C3)CO

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)N2CCCC(C2)(CCCC3=CC=CC=C3)CO

InChI

InChI=1S/C23H29NO2S/c1-27-21-12-10-20(11-13-21)22(26)24-16-6-15-23(17-24,18-25)14-5-9-19-7-3-2-4-8-19/h2-4,7-8,10-13,25H,5-6,9,14-18H2,1H3