Vitas-M small molecule compound
3-[(acetyloxy)methyl]-7-{[(1,3-diphenyl-1H-pyrazol-4-yl)carbonyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STL403333
SMILES CC(=O)OCC1=C(C(=O)O)N2C(SC1)C(C2=O)NC(=O)c1cn(nc1c1ccccc1)c1ccccc1
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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 C26H22N4O6S MW 518.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O6S/c1-15(31)36-13-17-14-37-25-21(24(33)30(25)22(17)26(34)35)27-23(32)19-12-29(18-10-6-3-7-11-18)28-20(19)16-8-4-2-5-9-16/h2-12,21,25H,13-14H2,1H3,(H,27,32)(H,34,35)InChIKey
DNAFQTSGJFWVTJ-UHFFFAOYSA-NSynonyms
1214062-25-51214062255
3((acetyloxy)methyl)7(((13diphenyl1Hpyrazol4yl)carbonyl)amino)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
3(ACETYLOXYMETHYL)7((13DIPHENYLPYRAZOLE4CARBONYL)AMINO)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5)SC1)C(=O)O
InChI=1SC26H22N4O6Sc115(31)36131714372521(24(33)30(25)22(17)26(34)35)2723(32)191229(18106371118)2820(19)168425916h2122125H1314H21H3(H2732)(H3435)
MFCD04046467
ZINC000013640263
ZINC000013640269
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