Vitas-M small molecule compound
[(4-cyclopropyl-5-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetic acid
Catalog ID
STL179016
SMILES CCc1nnc(n1C1CC1)SCC(=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 C9H13N3O2S MW 227.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H13N3O2S/c1-2-7-10-11-9(15-5-8(13)14)12(7)6-3-4-6/h6H,2-5H2,1H3,(H,13,14)InChIKey
GPUOXNZVYFKOTC-UHFFFAOYSA-NSynonyms
((4cyclopropyl5ethyl4H124triazol3yl)sulfanyl)aceticacid
2((4cyclopropyl5ethyl124triazol3yl)sulfanyl)aceticacid
CCC1=NN=C(N1C2CC2)SCC(=O)O
InChI=1SC9H13N3O2Sc12710119(1558(13)14)12(7)6346h6H25H21H3(H1314)
MFCD08556662
ZINC000020592036
ZINC20592036
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