Vitas-M small molecule compound
7-({[5-cyclopropyl-3-(difluoromethyl)-1H-pyrazol-1-yl]acetyl}amino)-3-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STL405670
SMILES O=C(Cn1nc(cc1C1CC1)C(F)F)NC1C(=O)N2C1SCC(=C2C(=O)O)CSc1nnnn1C
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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 C19H20F2N8O4S2 MW 526.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20F2N8O4S2/c1-27-19(23-25-26-27)35-7-9-6-34-17-13(16(31)29(17)14(9)18(32)33)22-12(30)5-28-11(8-2-3-8)4-10(24-28)15(20)21/h4,8,13,15,17H,2-3,5-7H2,1H3,(H,22,30)(H,32,33)InChIKey
NGEHZQYUQUZTQF-UHFFFAOYSA-NSynonyms
1214040-49-91214040499
7(((5cyclopropyl3(difluoromethyl)1Hpyrazol1yl)acetyl)amino)3(((1methyl1Htetrazol5yl)sulfanyl)methyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
7(((5CYCLOPROPYL3(DIFLUOROMETHYL)1HPYRAZOL1YL)ACETYL)AMINO)3(((1METHYL1HTETRAZOL5YL)THIO)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7((2(5CYCLOPROPYL3(DIFLUOROMETHYL)PYRAZOL1YL)ACETYL)AMINO)3((1METHYLTETRAZOL5YL)SULFANYLMETHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)CN4C(=CC(=N4)C(F)F)C5CC5)SC2)C(=O)O
InChI=1SC19H20F2N8O4S2c12719(23252627)35796341713(16(31)29(17)14(9)18(32)33)2212(30)52811(8238)410(2428)15(20)21h48131517H2357H21H3(H2230)(H3233)
MFCD05667384
ZINC000002732930
ZINC000002732933
Check stock
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Check stock on Vitas-MAvailable files
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