Vitas-M small molecule compound
2-(2-{[3-chloro-4-(1H-1,2,4-triazol-1-yl)phenyl]amino}-2-oxoethyl)benzoic acid
Catalog ID
STL151875
SMILES O=C(Cc1ccccc1C(=O)O)Nc1ccc(c(c1)Cl)n1cncn1
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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 C17H13ClN4O3 MW 356.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN4O3/c18-14-8-12(5-6-15(14)22-10-19-9-20-22)21-16(23)7-11-3-1-2-4-13(11)17(24)25/h1-6,8-10H,7H2,(H,21,23)(H,24,25)InChIKey
XOLGTJJVEKDXLC-UHFFFAOYSA-NSynonyms
1324072-33-41324072334
2(2((3chloro4(1H124triazol1yl)phenyl)amino)2oxoethyl)benzoicacid
2(2(3chloro4(124triazol1yl)anilino)2oxoethyl)benzoicacid
C1=CC=C(C(=C1)CC(=O)NC2=CC(=C(C=C2)N3C=NC=N3)Cl)C(=O)O
InChI=1SC17H13ClN4O3c1814812(5615(14)22101992022)2116(23)711312413(11)17(24)25h16810H7H2(H2123)(H2425)
MFCD19708539
ZINC000071279822
ZINC71279822
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