Vitas-M small molecule compound
2-chlorobenzyl 4-(4H-1,2,4-triazol-4-yl)benzoate
Catalog ID
STK743776
SMILES O=C(c1ccc(cc1)n1cnnc1)OCc1ccccc1Cl
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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 C16H12ClN3O2 MW 313.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3O2/c17-15-4-2-1-3-13(15)9-22-16(21)12-5-7-14(8-6-12)20-10-18-19-11-20/h1-8,10-11H,9H2InChIKey
VRGZLWZWXQOUNN-UHFFFAOYSA-NSynonyms
(2CHLOROPHENYL)METHYL4(124TRIAZOL4YL)BENZOATE
2chlorobenzyl4(4H124triazol4yl)benzoate
C1=CC=C(C(=C1)COC(=O)C2=CC=C(C=C2)N3C=NN=C3)Cl
InChI=1SC16H12ClN3O2c1715421313(15)92216(21)125714(8612)201018191120h181011H9H2
MFCD05855533
ZINC000000529280
ZINC00529280
ZINC529280
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