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

CAS No.
741731-80-6
CCD No.
CCD00386665
Formula
C13 H15 N3 O2 S
MolWeight
277.346

Basic Information

Product Name: ([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
CAS: 741731-80-6
English Synonyms: 2-([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETIC ACID ; ([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID ; ([4-ETHYL-5-(2-METHYLPHENYL)-1,2,4-TRIAZOL-3-YL]SULFANYL)ACETIC ACID
MDL Number.: MFCD03429376
H bond acceptor: 5
H bond donor: 1
Smile: CCn1c(nnc1SCC(=O)O)c2ccccc2C
InChi: InChI=1S/C13H15N3O2S/c1-3-16-12(10-7-5-4-6-9(10)2)14-15-13(16)19-8-11(17)18/h4-7H,3,8H2,1-2H3,(H,17,18)
InChiKey: InChIKey=FUJOXKPOSMNFOS-UHFFFAOYSA-N

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