3-chloranyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine

Systemtic Name: 3-chloranyl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine Openeye Name: 3-chloro-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-5-(trifluoromethyl)pyridine CAS Name: 3-chloro-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]-5-(trifluoromethyl)pyridine IUPAC Name: 3-chloro-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine Traditional Name: 3-chloro-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]-5-(trifluoromethyl)pyridine Formula: C13H7ClF3N5S MolecularWeight: 357.74139

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=NC(=NN2)SC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C1=CN=CC=C1C2=NC(=NN2)SC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C13H7ClF3N5S/c14-9-5-8(13(15,16)17)6-19-11(9)23-12-20-10(21-22-12)7-1-3-18-4-2-7/h1-6H,(H,20,21,22)