4-(hydroxymethyl)-N-(3-methylsulfanylphenyl)-4-phenethyl-piperidine-1-carboxamide

Systemtic Name: 4-(hydroxymethyl)-N-(3-methylsulfanylphenyl)-4-phenethyl-piperidine-1-carboxamide Openeye Name: 4-(hydroxymethyl)-N-(3-methylsulfanylphenyl)-4-phenethyl-piperidine-1-carboxamide CAS Name: 4-(hydroxymethyl)-N-[3-(methylthio)phenyl]-4-phenethyl-1-piperidinecarboxamide IUPAC Name: 4-(hydroxymethyl)-N-(3-methylsulfanylphenyl)-4-phenethylpiperidine-1-carboxamide Traditional Name: 4-methylol-N-[3-(methylthio)phenyl]-4-phenethyl-piperidine-1-carboxamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)N2CCC(CC2)(CCC3=CC=CC=C3)CO

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)N2CCC(CC2)(CCC3=CC=CC=C3)CO

InChI

InChI=1S/C22H28N2O2S/c1-27-20-9-5-8-19(16-20)23-21(26)24-14-12-22(17-25,13-15-24)11-10-18-6-3-2-4-7-18/h2-9,16,25H,10-15,17H2,1H3,(H,23,26)