Vitas-M small molecule compound
7-{[(1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}-3-{[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Catalog ID
STL405693
SMILES CCn1nccc1C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)CSc1nnc(s1)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 C17H18N6O4S3 MW 466.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N6O4S3/c1-3-22-10(4-5-18-22)13(24)19-11-14(25)23-12(16(26)27)9(6-28-15(11)23)7-29-17-21-20-8(2)30-17/h4-5,11,15H,3,6-7H2,1-2H3,(H,19,24)(H,26,27)InChIKey
QTGSGHXAKGMFDA-UHFFFAOYSA-NSynonyms
1214241-00-51214241005
7(((1ethyl1Hpyrazol5yl)carbonyl)amino)3(((5methyl134thiadiazol2yl)sulfanyl)methyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
7((2ETHYLPYRAZOLE3CARBONYL)AMINO)3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CCN1C(=CC=N1)C(=O)NC2C3N(C2=O)C(=C(CS3)CSC4=NN=C(S4)C)C(=O)O
InChI=1SC17H18N6O4S3c132210(451822)13(24)191114(25)2312(16(26)27)9(62815(11)23)7291721208(2)3017h451115H367H212H3(H1924)(H2627)
MFCD04139940
ZINC000002730709
ZINC000002730712
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