N-methyl-N-[2-(2-methylphenyl)-1-[1-(2-methylsulfanylethanoyl)piperidin-4-yl]ethyl]-2-pyrazol-1-yl-ethanamide

Systemtic Name: N-methyl-N-[2-(2-methylphenyl)-1-[1-(2-methylsulfanylethanoyl)piperidin-4-yl]ethyl]-2-pyrazol-1-yl-ethanamide Openeye Name: N-methyl-N-[1-[1-(2-methylsulfanylacetyl)-4-piperidyl]-2-(o-tolyl)ethyl]-2-pyrazol-1-yl-acetamide CAS Name: N-methyl-N-[2-(2-methylphenyl)-1-[1-[2-(methylthio)-1-oxoethyl]-4-piperidinyl]ethyl]-2-(1-pyrazolyl)acetamide IUPAC Name: N-methyl-N-[2-(2-methylphenyl)-1-[1-(2-methylsulfanylacetyl)piperidin-4-yl]ethyl]-2-pyrazol-1-ylacetamide Traditional Name: N-methyl-N-[1-[1-[2-(methylthio)acetyl]-4-piperidyl]-2-(o-tolyl)ethyl]-2-pyrazol-1-yl-acetamide Formula: C23H32N4O2S MolecularWeight: 428.59078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(C2CCN(CC2)C(=O)CSC)N(C)C(=O)CN3C=CC=N3

Isomeric SMILES

CC1=CC=CC=C1CC(C2CCN(CC2)C(=O)CSC)N(C)C(=O)CN3C=CC=N3

InChI

InChI=1S/C23H32N4O2S/c1-18-7-4-5-8-20(18)15-21(25(2)22(28)16-27-12-6-11-24-27)19-9-13-26(14-10-19)23(29)17-30-3/h4-8,11-12,19,21H,9-10,13-17H2,1-3H3