([5-(4-FLUOROPHENYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID

CAS No.
731827-00-2
CCD No.
CCD00440886
Formula
C16 H12 F N3 O2 S
MolWeight
329.354

Basic Information

Product Name: ([5-(4-FLUOROPHENYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
CAS: 731827-00-2
English Synonyms: ([5-(4-FLUOROPHENYL)-4-PHENYL-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETIC ACID ; BUTTPARK 66\41-83 ; ([5-(4-FLUOROPHENYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID ; 2-([5-(4-FLUOROPHENYL)-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETIC ACID
MDL Number.: MFCD04036391
H bond acceptor: 5
H bond donor: 1
Smile: c1ccc(cc1)n2c(nnc2SCC(=O)O)c3ccc(cc3)F
InChi: InChI=1S/C16H12FN3O2S/c17-12-8-6-11(7-9-12)15-18-19-16(23-10-14(21)22)20(15)13-4-2-1-3-5-13/h1-9H,10H2,(H,21,22)
InChiKey: InChIKey=IDFOHMGTLKLWGA-UHFFFAOYSA-N

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