Vitas-M small molecule compound
7-{[hydroxy(phenyl)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
STK177294
SMILES OC(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)CSc1nnnn1C)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 C18H18N6O5S2 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N6O5S2/c1-23-18(20-21-22-23)31-8-10-7-30-16-11(15(27)24(16)12(10)17(28)29)19-14(26)13(25)9-5-3-2-4-6-9/h2-6,11,13,16,25H,7-8H2,1H3,(H,19,26)(H,28,29)InChIKey
OLVCFLKTBJRLHI-UHFFFAOYSA-NSynonyms
5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID7((2HYDROXY2PHENYLACETYL)AMINO)3(((1METHYL1HTETRAZOL5YL)THIO)METHYL)8OXO
7((2HYDROXY2PHENYLACETYL)AMINO)3((1METHYLTETRAZOL5YL)SULFANYLMETHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7((HYDROXY(PHENYL)ACETYL)AMINO)3(((1METHYL1HTETRAZOL5YL)SULFANYL)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CN1C(=NN=N1)SCC2=C(N3C(C(C3=O)NC(=O)C(C4=CC=CC=C4)O)SC2)C(=O)O
InChI=1SC18H18N6O5S2c12318(20212223)318107301611(15(27)24(16)12(10)17(28)29)1914(26)13(25)9532469h2611131625H78H21H3(H1926)(H2829)
MFCD02114247
ZINC000001530585
ZINC000003977816
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