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

CAS No.
722490-57-5
CCD No.
CCD00435532
Formula
C18 H14 N4 O2 S3
MolWeight
414.533

Basic Information

Product Name: ((5-[(1,3-BENZOTHIAZOL-2-YLTHIO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID
CAS: 722490-57-5
English Synonyms: ((5-[(1,3-BENZOTHIAZOL-2-YLTHIO)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)THIO)ACETIC ACID ; ((5-[(1,3-BENZOTHIAZOL-2-YLSULFANYL)METHYL]-4-PHENYL-1,2,4-TRIAZOL-3-YL)SULFANYL)ACETIC ACID ; 2-((5-[(1,3-BENZOTHIAZOL-2-YLSULFANYL)METHYL]-4-PHENYL-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)ACETIC ACID
MDL Number.: MFCD03959825
H bond acceptor: 6
H bond donor: 1
Smile: c1ccc(cc1)n2c(nnc2SCC(=O)O)CSc3nc4ccccc4s3
InChi: InChI=1S/C18H14N4O2S3/c23-16(24)11-25-17-21-20-15(22(17)12-6-2-1-3-7-12)10-26-18-19-13-8-4-5-9-14(13)27-18/h1-9H,10-11H2,(H,23,24)
InChiKey: InChIKey=KQXGIPUHEMMTQT-UHFFFAOYSA-N

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