3-[(3R,4R)-3,4-dimethyl-1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]benzamide

Systemtic Name: 3-[(3R,4R)-3,4-dimethyl-1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]benzamide Openeye Name: 3-[(3R,4R)-3,4-dimethyl-1-[(4-methylsulfanylphenyl)methyl]-4-piperidyl]benzamide CAS Name: 3-[(3R,4R)-3,4-dimethyl-1-[[4-(methylthio)phenyl]methyl]-4-piperidinyl]benzamide IUPAC Name: 3-[(3R,4R)-3,4-dimethyl-1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]benzamide Traditional Name: 3-[(3R,4R)-3,4-dimethyl-1-[4-(methylthio)benzyl]-4-piperidyl]benzamide Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1(C)C2=CC=CC(=C2)C(=O)N)CC3=CC=C(C=C3)SC

Isomeric SMILES

C[C@H]1CN(CC[C@@]1(C)C2=CC=CC(=C2)C(=O)N)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H28N2OS/c1-16-14-24(15-17-7-9-20(26-3)10-8-17)12-11-22(16,2)19-6-4-5-18(13-19)21(23)25/h4-10,13,16H,11-12,14-15H2,1-3H3,(H2,23,25)/t16-,22+/m0/s1