N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-4-(trifluoromethylsulfanyl)benzamide

Systemtic Name: N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]-4-(trifluoromethylsulfanyl)benzamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(trifluoromethylsulfanyl)benzamide CAS Name: N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-4-(trifluoromethylthio)benzamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(trifluoromethylsulfanyl)benzamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-N-methyl-4-(trifluoromethylthio)benzamide Formula: C20H18F3N3OS MolecularWeight: 405.43663

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)SC(F)(F)F

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)C(=O)C3=CC=C(C=C3)SC(F)(F)F

InChI

InChI=1S/C20H18F3N3OS/c1-25(19(27)17-7-9-18(10-8-17)28-20(21,22)23)12-16-11-24-26(14-16)13-15-5-3-2-4-6-15/h2-11,14H,12-13H2,1H3