N-[3-[bis(fluoranyl)methyl]-5-ethylsulfanyl-1,2,4-triazol-4-yl]-4-bromanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[bis(fluoranyl)methyl]-5-ethylsulfanyl-1,2,4-triazol-4-yl]-4-bromanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-1-methyl-pyrazole-3-carboxamide CAS Name: 4-bromo-N-[3-(difluoromethyl)-5-(ethylthio)-1,2,4-triazol-4-yl]-1-methyl-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[3-(difluoromethyl)-5-ethylsulfanyl-1,2,4-triazol-4-yl]-1-methylpyrazole-3-carboxamide Traditional Name: 4-bromo-N-[3-(difluoromethyl)-5-(ethylthio)-1,2,4-triazol-4-yl]-1-methyl-pyrazole-3-carboxamide Formula: C10H11BrF2N6OS MolecularWeight: 381.199746

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1NC(=O)C2=NN(C=C2Br)C)C(F)F

Isomeric SMILES

CCSC1=NN=C(N1NC(=O)C2=NN(C=C2Br)C)C(F)F

InChI

InChI=1S/C10H11BrF2N6OS/c1-3-21-10-15-14-8(7(12)13)19(10)17-9(20)6-5(11)4-18(2)16-6/h4,7H,3H2,1-2H3,(H,17,20)