S-[5-(trifluoromethyl)pyridin-2-yl] 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carbothioate

Systemtic Name: S-[5-(trifluoromethyl)pyridin-2-yl] 5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carbothioate Openeye Name: S-[5-(trifluoromethyl)-2-pyridyl] 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carbothioate CAS Name: 5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-2-furancarbothioic acid S-[5-(trifluoromethyl)-2-pyridinyl] ester IUPAC Name: S-[5-(trifluoromethyl)pyridin-2-yl] 5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]furan-2-carbothioate Traditional Name: 5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carbothioic acid S-[5-(trifluoromethyl)-2-pyridyl] ester Formula: C17H13BrF3N3O2S MolecularWeight: 460.26823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)SC3=NC=C(C=C3)C(F)(F)F)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)SC3=NC=C(C=C3)C(F)(F)F)C)Br

InChI

InChI=1S/C17H13BrF3N3O2S/c1-9-15(18)10(2)24(23-9)8-12-4-5-13(26-12)16(25)27-14-6-3-11(7-22-14)17(19,20)21/h3-7H,8H2,1-2H3