2-cyano-3-[2,5-dimethyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]phenyl]prop-2-enethioamide

Systemtic Name: 2-cyano-3-[2,5-dimethyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]phenyl]prop-2-enethioamide Openeye Name: 2-cyano-3-[2,5-dimethyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]phenyl]prop-2-enethioamide CAS Name: 2-cyano-3-[2,5-dimethyl-3-[[3-(trifluoromethyl)-1-pyrazolyl]methyl]phenyl]-2-propenethioamide IUPAC Name: 2-cyano-3-[2,5-dimethyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]phenyl]prop-2-enethioamide Traditional Name: 2-cyano-3-[2,5-dimethyl-3-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]phenyl]thioacrylamide Formula: C17H15F3N4S MolecularWeight: 364.38801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C=C(C#N)C(=S)N)C)CN2C=CC(=N2)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C(=C1)C=C(C#N)C(=S)N)C)CN2C=CC(=N2)C(F)(F)F

InChI

InChI=1S/C17H15F3N4S/c1-10-5-12(7-13(8-21)16(22)25)11(2)14(6-10)9-24-4-3-15(23-24)17(18,19)20/h3-7H,9H2,1-2H3,(H2,22,25)