Vitas-M small molecule compound
(3E)-4-(4-bromophenyl)-2-(pyridin-4-yl)-1-(1H-1,2,4-triazol-1-yl)but-3-en-2-ol
Catalog ID
STK329082
SMILES Brc1ccc(cc1)/C=C/C(c1ccncc1)(Cn1cncn1)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H15BrN4O MW 371.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4O/c18-16-3-1-14(2-4-16)5-8-17(23,11-22-13-20-12-21-22)15-6-9-19-10-7-15/h1-10,12-13,23H,11H2/b8-5+InChIKey
DJRTTZXGSZUDAD-VMPITWQZSA-NSynonyms
(3E)4(4bromophenyl)2(pyridin4yl)1(1H124triazol1yl)but3en2ol
(E)4(4bromophenyl)2pyridin4yl1(124triazol1yl)but3en2ol
Brc1ccc(cc1)C=CC(c1ccncc1)(Cn1cncn1)O
C1=CC(=CC=C1C=CC(CN2C=NC=N2)(C3=CC=NC=C3)O)Br
InChI=1SC17H15BrN4Oc18163114(2416)5817(2311221320122122)15691910715h110121323H11H2b85+
MFCD09961723
ZINC000018191402
ZINC000018191405
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