1-methyl-5-(pyridin-4-ylmethylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]pyrazole-4-carboxamide

Systemtic Name: 1-methyl-5-(pyridin-4-ylmethylsulfanyl)-N-[4-(trifluoromethyloxy)phenyl]pyrazole-4-carboxamide Openeye Name: 1-methyl-5-(4-pyridylmethylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxamide CAS Name: 1-methyl-5-(pyridin-4-ylmethylthio)-N-[4-(trifluoromethoxy)phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-methyl-5-(pyridin-4-ylmethylsulfanyl)-N-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxamide Traditional Name: 1-methyl-5-(4-pyridylmethylthio)-N-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxamide Formula: C18H15F3N4O2S MolecularWeight: 408.39751

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)NC2=CC=C(C=C2)OC(F)(F)F)SCC3=CC=NC=C3

Isomeric SMILES

CN1C(=C(C=N1)C(=O)NC2=CC=C(C=C2)OC(F)(F)F)SCC3=CC=NC=C3

InChI

InChI=1S/C18H15F3N4O2S/c1-25-17(28-11-12-6-8-22-9-7-12)15(10-23-25)16(26)24-13-2-4-14(5-3-13)27-18(19,20)21/h2-10H,11H2,1H3,(H,24,26)