2-[4-(4-BROMO-PHENYL)-5-MERCAPTO-4H-[1,2,4]TRIAZOL-3-YL]-PHENOL

CAS No.
81518-27-6
CCD No.
CCD00435445
Formula
C14 H10 Br N3 O S
MolWeight
348.223

Basic Information

Product Name: 2-[4-(4-BROMO-PHENYL)-5-MERCAPTO-4H-[1,2,4]TRIAZOL-3-YL]-PHENOL
CAS: 81518-27-6
English Synonyms: 2-[4-(4-BROMO-PHENYL)-5-MERCAPTO-4H-[1,2,4]TRIAZOL-3-YL]-PHENOL
MDL Number.: MFCD03956508
H bond acceptor: 4
H bond donor: 1
Smile: c1ccc(c(c1)c2nnc(n2c3ccc(cc3)Br)S)O
InChi: InChI=1S/C14H10BrN3OS/c15-9-5-7-10(8-6-9)18-13(16-17-14(18)20)11-3-1-2-4-12(11)19/h1-8,19H,(H,17,20)
InChiKey: InChIKey=KUMSNWAQJIDGRP-UHFFFAOYSA-N

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