2-[5-chloranyl-3-methyl-1-[2,2,2-tris(fluoranyl)ethyl]pyrazol-4-yl]-N,N-diethyl-3-sulfanylidene-1,2,4-triazole-1-carboxamide

Systemtic Name: 2-[5-chloranyl-3-methyl-1-[2,2,2-tris(fluoranyl)ethyl]pyrazol-4-yl]-N,N-diethyl-3-sulfanylidene-1,2,4-triazole-1-carboxamide Openeye Name: 2-[5-chloro-3-methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-N,N-diethyl-3-thioxo-1,2,4-triazole-1-carboxamide CAS Name: 2-[5-chloro-3-methyl-1-(2,2,2-trifluoroethyl)-4-pyrazolyl]-N,N-diethyl-3-sulfanylidene-1,2,4-triazole-1-carboxamide IUPAC Name: 2-[5-chloro-3-methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-N,N-diethyl-3-sulfanylidene-1,2,4-triazole-1-carboxamide Traditional Name: 2-[5-chloro-3-methyl-1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-N,N-diethyl-3-thioxo-1,2,4-triazole-1-carboxamide Formula: C13H16ClF3N6OS MolecularWeight: 396.81895

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=NC(=S)N1C2=C(N(N=C2C)CC(F)(F)F)Cl

Isomeric SMILES

CCN(CC)C(=O)N1C=NC(=S)N1C2=C(N(N=C2C)CC(F)(F)F)Cl

InChI

InChI=1S/C13H16ClF3N6OS/c1-4-20(5-2)12(24)22-7-18-11(25)23(22)9-8(3)19-21(10(9)14)6-13(15,16)17/h7H,4-6H2,1-3H3