Vitas-M small molecule compound

2-[(9-ethyl-9H-[1,2,4]triazolo[4,3-a]benzimidazol-3-yl)sulfanyl]propanoic acid

Catalog ID
STK695892
SMILES CCn1c2nnc(n2c2c1cccc2)SC(C(=O)O)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 C13H14N4O2S MW 290.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N4O2S/c1-3-16-9-6-4-5-7-10(9)17-12(16)14-15-13(17)20-8(2)11(18)19/h4-8H,3H2,1-2H3,(H,18,19)
InChIKey
BHEVJCPGHPYCDR-UHFFFAOYSA-N
Synonyms
704875-04-7
2((4ETHYL(124)TRIAZOLO(43A)BENZIMIDAZOL1YL)SULFANYL)PROPANOICACID
2((9ethyl9H(124)triazolo(43a)benzimidazol3yl)sulfanyl)propanoicacid
2((9ETHYL9H(124)TRIAZOLO(43A)BENZIMIDAZOL3YL)THIO)PROPANOICACID
704875047
CCN1C2=CC=CC=C2N3C1=NN=C3SC(C)C(=O)O
InChI=1SC13H14N4O2Sc13169645710(9)1712(16)141513(17)208(2)11(18)19h48H3H212H3(H1819)
MFCD05241144
ZINC000000611682
ZINC000000611683

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Available files

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