Vitas-M small molecule compound
methyl N-{[4-fluoro-2-(1H-tetrazol-1-yl)phenyl]carbonyl}valinate
Catalog ID
STL235871
SMILES COC(=O)C(C(C)C)NC(=O)c1ccc(cc1n1cnnn1)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 C14H16FN5O3 MW 321.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16FN5O3/c1-8(2)12(14(22)23-3)17-13(21)10-5-4-9(15)6-11(10)20-7-16-18-19-20/h4-8,12H,1-3H3,(H,17,21)InChIKey
PMBUIMNEEFGZKZ-UHFFFAOYSA-NSynonyms
(S)methyl2(4fluoro2(1Htetrazol1yl)benzamido)3methylbutanoate
CC(C)C(C(=O)OC)NC(=O)C1=C(C=C(C=C1)F)N2C=NN=N2
COC(=O)(C@H)(C(C)C)NC(=O)c1ccc(cc1n1cnnn1)F
InChI=1SC14H16FN5O3c18(2)12(14(22)233)1713(21)10549(15)611(10)20716181920h4812H13H3(H1721)
methyl2((4fluoro2(tetrazol1yl)benzoyl)amino)3methylbutanoate
methylN((4fluoro2(1Htetrazol1yl)phenyl)carbonyl)valinate
MFCD24858584
ZINC000020734907
ZINC000080356275
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