N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-pyridin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-2-pyridin-2-ylsulfanyl-ethanamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-(2-pyridylsulfanyl)acetamide CAS Name: N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-(2-pyridinylthio)acetamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-2-pyridin-2-ylsulfanylacetamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-2-(2-pyridylthio)acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)CSC3=CC=CC=N3

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C20H22N4OS/c1-15-18(12-22-19(25)14-26-20-10-6-7-11-21-20)16(2)24(23-15)13-17-8-4-3-5-9-17/h3-11H,12-14H2,1-2H3,(H,22,25)