Vitas-M small molecule compound

methyl [(5-ethyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate

Catalog ID
STK470128
SMILES COC(=O)CSc1nnc(n1C)CC

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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 C8H13N3O2S MW 215.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H13N3O2S/c1-4-6-9-10-8(11(6)2)14-5-7(12)13-3/h4-5H2,1-3H3
InChIKey
QRRSMRPWSLDSJH-UHFFFAOYSA-N
Synonyms

CCC1=NN=C(N1C)SCC(=O)OC
InChI=1SC8H13N3O2Sc1469108(11(6)2)1457(12)133h45H213H3
methyl((5ethyl4methyl4H124triazol3yl)sulfanyl)acetate
methyl2((5ethyl4methyl124triazol3yl)sulfanyl)acetate
METHYL2(5ETHYL4METHYL124TRIAZOL3YLTHIO)ACETATE
MFCD05082084
ZINC000016970109
ZINC16970109

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.