Vitas-M small molecule compound
methyl N-{[2-chloro-5-(1H-tetrazol-1-yl)phenyl]carbonyl}-beta-alaninate
Catalog ID
STK643323
SMILES COC(=O)CCNC(=O)c1cc(ccc1Cl)n1cnnn1
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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)9-6-8(2-3-10(9)13)18-7-15-16-17-18/h2-3,6-7H,4-5H2,1H3,(H,14,20)InChIKey
FIJRSBLLJMGVEN-UHFFFAOYSA-NSynonyms
1040689-47-11040689471
COC(=O)CCNC(=O)C1=C(C=CC(=C1)N2C=NN=N2)Cl
InChI=1SC12H12ClN5O3c12111(19)451412(20)968(2310(9)13)18715161718h2367H45H21H3(H1420)
methyl3((2chloro5(tetrazol1yl)benzoyl)amino)propanoate
methyl3(2chloro5(1Htetrazol1yl)benzamido)propanoate
methylN((2chloro5(1Htetrazol1yl)phenyl)carbonyl)betaalaninate
MFCD12206323
ZINC000020721383
ZINC20721383
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