N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide CAS Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-[[4-(methylthio)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[3-(dimethylamino)-2,2-dimethylpropyl]-1-[(4-methylsulfanylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-[3-(dimethylamino)-2,2-dimethyl-propyl]-1-[4-(methylthio)benzyl]isonipecotamide Formula: C21H35N3OS MolecularWeight: 377.5871

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C1CCN(CC1)CC2=CC=C(C=C2)SC)CN(C)C

Isomeric SMILES

CC(C)(CNC(=O)C1CCN(CC1)CC2=CC=C(C=C2)SC)CN(C)C

InChI

InChI=1S/C21H35N3OS/c1-21(2,16-23(3)4)15-22-20(25)18-10-12-24(13-11-18)14-17-6-8-19(26-5)9-7-17/h6-9,18H,10-16H2,1-5H3,(H,22,25)