5-chloranyl-7-(2-methoxyphenyl)sulfanyl-6-[2,4,6-tris(fluoranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5-chloranyl-7-(2-methoxyphenyl)sulfanyl-6-[2,4,6-tris(fluoranyl)phenyl]-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 5-chloro-7-(2-methoxyphenyl)sulfanyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5-chloro-7-[(2-methoxyphenyl)thio]-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 5-chloro-7-(2-methoxyphenyl)sulfanyl-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 5-chloro-7-[(2-methoxyphenyl)thio]-6-(2,4,6-trifluorophenyl)-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C18H10ClF3N4OS MolecularWeight: 422.81141

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1SC2=C(C(=NC3=NC=NN23)Cl)C4=C(C=C(C=C4F)F)F

Isomeric SMILES

COC1=CC=CC=C1SC2=C(C(=NC3=NC=NN23)Cl)C4=C(C=C(C=C4F)F)F

InChI

InChI=1S/C18H10ClF3N4OS/c1-27-12-4-2-3-5-13(12)28-17-15(14-10(21)6-9(20)7-11(14)22)16(19)25-18-23-8-24-26(17)18/h2-8H,1H3