Vitas-M small molecule compound
7-(butanoylamino)-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
STL177594
SMILES CCCC(=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 C15H18N4O4S3 MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O4S3/c1-3-4-9(20)16-10-12(21)19-11(14(22)23)8(5-24-13(10)19)6-25-15-18-17-7(2)26-15/h10,13H,3-6H2,1-2H3,(H,16,20)(H,22,23)InChIKey
MKMHIATWCCLREP-UHFFFAOYSA-NSynonyms
1214122-60-71214122607
7(butanoylamino)3(((5methyl134thiadiazol2yl)sulfanyl)methyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
7(BUTANOYLAMINO)3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
CCCC(=O)NC1C2N(C1=O)C(=C(CS2)CSC3=NN=C(S3)C)C(=O)O
InChI=1SC15H18N4O4S3c1349(20)161012(21)1911(14(22)23)8(52413(10)19)6251518177(2)2615h1013H36H212H3(H1620)(H2223)
MFCD04134081
ZINC000002803251
ZINC000002803254
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