Vitas-M small molecule compound
3-[(acetyloxy)methyl]-7-{[(1-ethyl-3-methyl-1H-pyrazol-4-yl)carbonyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STK305017
SMILES CCn1nc(c(c1)C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)C)C
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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 C17H20N4O6S MW 408.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O6S/c1-4-20-5-11(8(2)19-20)14(23)18-12-15(24)21-13(17(25)26)10(6-27-9(3)22)7-28-16(12)21/h5,12,16H,4,6-7H2,1-3H3,(H,18,23)(H,25,26)InChIKey
WNKVSGZZYCCMOV-UHFFFAOYSA-NSynonyms
1214070-61-71214070617
3((acetyloxy)methyl)7(((1ethyl3methyl1Hpyrazol4yl)carbonyl)amino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
3(ACETYLOXYMETHYL)7((1ETHYL3METHYLPYRAZOLE4CARBONYL)AMINO)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CCN1C=C(C(=N1)C)C(=O)NC2C3N(C2=O)C(=C(CS3)COC(=O)C)C(=O)O
InChI=1SC17H20N4O6Sc1420511(8(2)1920)14(23)181215(24)2113(17(25)26)10(6279(3)22)72816(12)21h51216H467H213H3(H1823)(H2526)
MFCD04049595
ZINC000013959418
ZINC000013959421
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