Vitas-M small molecule compound
2-(3-benzyl-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl)-N-(3-chloro-4-fluorophenyl)acetamide
Catalog ID
STK879397
SMILES O=C(Cn1cnc2c(c1=O)nnn2Cc1ccccc1)Nc1ccc(c(c1)Cl)F
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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 C19H14ClFN6O2 MW 412.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14ClFN6O2/c20-14-8-13(6-7-15(14)21)23-16(28)10-26-11-22-18-17(19(26)29)24-25-27(18)9-12-4-2-1-3-5-12/h1-8,11H,9-10H2,(H,23,28)InChIKey
QJIFGZIMIMRUKK-UHFFFAOYSA-NSynonyms
2(3benzyl7oxo37dihydro6H(123)triazolo(45d)pyrimidin6yl)N(3chloro4fluorophenyl)acetamide
2(3benzyl7oxotriazolo(45d)pyrimidin6yl)N(3chloro4fluorophenyl)acetamide
C1=CC=C(C=C1)CN2C3=C(C(=O)N(C=N3)CC(=O)NC4=CC(=C(C=C4)F)Cl)N=N2
InChI=1SC19H14ClFN6O2c2014813(6715(14)21)2316(28)102611221817(19(26)29)242527(18)9124213512h1811H910H2(H2328)
MFCD18170734
ZINC000040478180
ZINC40478180
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