Vitas-M small molecule compound
methyl N-{[4-chloro-2-(1H-tetrazol-1-yl)phenyl]carbonyl}-beta-alaninate
Catalog ID
STK718846
SMILES COC(=O)CCNC(=O)c1ccc(cc1n1cnnn1)Cl
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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 C12H12ClN5O3 MW 309.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12ClN5O3/c1-21-11(19)4-5-14-12(20)9-3-2-8(13)6-10(9)18-7-15-16-17-18/h2-3,6-7H,4-5H2,1H3,(H,14,20)InChIKey
HNJQTJBCRNFCSQ-UHFFFAOYSA-NSynonyms
1040695-59-71040695597
COC(=O)CCNC(=O)C1=C(C=C(C=C1)Cl)N2C=NN=N2
InChI=1SC12H12ClN5O3c12111(19)451412(20)9328(13)610(9)18715161718h2367H45H21H3(H1420)
methyl3((4chloro2(tetrazol1yl)benzoyl)amino)propanoate
methyl3(4chloro2(1Htetrazol1yl)benzamido)propanoate
methylN((4chloro2(1Htetrazol1yl)phenyl)carbonyl)betaalaninate
MFCD12206711
ZINC000020427119
ZINC20427119
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