Vitas-M small molecule compound

7-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
STK177299
SMILES Cc1nnc(s1)SCC1=C(N2C(SC1)C(C2=O)N)C(=O)O

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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 C11H12N4O3S3 MW 344.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4O3S3/c1-4-13-14-11(21-4)20-3-5-2-19-9-6(12)8(16)15(9)7(5)10(17)18/h6,9H,2-3,12H2,1H3,(H,17,18)
InChIKey
HJSGHKMSDOLGJJ-UHFFFAOYSA-N
Synonyms

(6R7R)7amino3(((5methyl134thiadiazol2yl)thio)methyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylicacid
(6S7S)7AMMONIO3(((5METHYL134THIADIAZOL2YL)SULFANYL)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLATE
3(((5METHYL134THIADIAZOL2YL)THIO)METHYL)7AMINO8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
3((2METHYL134THIADIAZOL5YLTHIO)METHYL)7AMINO8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
3(5METHYL134THIADIAZOLE2YLTHIOMETHYL)7AMINO8OXO5THIA1AZABICYCLO(420)OCTA2ENE2CARBOXYLICACID
7AMINO3(((5METHYL134THIADIAZOL2YL)SULFANYL)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7AMINO3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLICACID
7AMMONIO3(((5METHYL134THIADIAZOL2YL)THIO)METHYL)8OXO5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLATE
7AZANIUMYL3((5METHYL134THIADIAZOL2YL)SULFANYLMETHYL)8OXIDANYLIDENE5THIA1AZABICYCLO(420)OCT2ENE2CARBOXYLATE
7azaniumyl3((5methyl134thiadiazol2yl)sulfanylmethyl)8oxo5thia1azabicyclo(420)oct2ene2carboxylate
CC1=NN=C(S1)SCC2=C(N3C(C(C3=O)(NH3+))SC2)C(=O)(O)
Cc1nnc(s1)SCC1=C(N2(C@H)(SC1)(C@@H)(C2=O)N)C(=O)O
InChI=1SC11H12N4O3S3c14131411(214)203521996(12)8(16)15(9)7(5)10(17)18h69H2312H21H3(H1718)
MFCD03037217
ZINC000004536655

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Available files

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