3-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-5,6-diphenyl-1,2,4-triazine

Systemtic Name: 3-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-5,6-diphenyl-1,2,4-triazine Openeye Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanyl]-5,6-diphenyl-1,2,4-triazine CAS Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]-5,6-diphenyl-1,2,4-triazine IUPAC Name: 3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanyl-5,6-diphenyl-1,2,4-triazine Traditional Name: 3-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]-5,6-diphenyl-1,2,4-triazine Formula: C21H12ClF3N4S MolecularWeight: 444.85999

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)SC3=C(C=C(C=N3)C(F)(F)F)Cl)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)SC3=C(C=C(C=N3)C(F)(F)F)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H12ClF3N4S/c22-16-11-15(21(23,24)25)12-26-19(16)30-20-27-17(13-7-3-1-4-8-13)18(28-29-20)14-9-5-2-6-10-14/h1-12H