5-methyl-N-(3-phenylsulfanylpropyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-N-(3-phenylsulfanylpropyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide Openeye Name: 5-methyl-N-(3-phenylsulfanylpropyl)-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide CAS Name: 5-methyl-N-[3-(phenylthio)propyl]-1-[5-(trifluoromethyl)-2-pyridinyl]-4-pyrazolecarboxamide IUPAC Name: 5-methyl-N-(3-phenylsulfanylpropyl)-1-[5-(trifluoromethyl)pyridin-2-yl]pyrazole-4-carboxamide Traditional Name: 5-methyl-N-[3-(phenylthio)propyl]-1-[5-(trifluoromethyl)-2-pyridyl]pyrazole-4-carboxamide Formula: C20H19F3N4OS MolecularWeight: 420.45127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NCCCSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C2=NC=C(C=C2)C(F)(F)F)C(=O)NCCCSC3=CC=CC=C3

InChI

InChI=1S/C20H19F3N4OS/c1-14-17(19(28)24-10-5-11-29-16-6-3-2-4-7-16)13-26-27(14)18-9-8-15(12-25-18)20(21,22)23/h2-4,6-9,12-13H,5,10-11H2,1H3,(H,24,28)