Vitas-M small molecule compound
3-[(acetyloxy)methyl]-7-{[(4-chloro-1-ethyl-1H-pyrazol-3-yl)carbonyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STK384694
SMILES CCn1cc(c(n1)C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)C)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 C16H17ClN4O6S MW 428.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O6S/c1-3-20-4-9(17)10(19-20)13(23)18-11-14(24)21-12(16(25)26)8(5-27-7(2)22)6-28-15(11)21/h4,11,15H,3,5-6H2,1-2H3,(H,18,23)(H,25,26)InChIKey
FLBVSFICUQZEDV-UHFFFAOYSA-NSynonyms
1214139-53-31214139533
3((acetyloxy)methyl)7(((4chloro1ethyl1Hpyrazol3yl)carbonyl)amino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
3(ACETYLOXYMETHYL)7((4CHLORO1ETHYLPYRAZOLE3CARBONYL)AMINO)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CCN1C=C(C(=N1)C(=O)NC2C3N(C2=O)C(=C(CS3)COC(=O)C)C(=O)O)Cl
InChI=1SC16H17ClN4O6Sc132049(17)10(1920)13(23)181114(24)2112(16(25)26)8(5277(2)22)62815(11)21h41115H356H212H3(H1823)(H2526)
MFCD04048632
ZINC000016193264
ZINC000016193272
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