Vitas-M small molecule compound

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

Catalog ID
STK470384
SMILES COC(=O)CSc1nnc(n1C)COc1ccccc1

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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 C13H15N3O3S MW 293.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N3O3S/c1-16-11(8-19-10-6-4-3-5-7-10)14-15-13(16)20-9-12(17)18-2/h3-7H,8-9H2,1-2H3
InChIKey
ZYFGONKMFZMNFG-UHFFFAOYSA-N
Synonyms

CN1C(=NN=C1SCC(=O)OC)COC2=CC=CC=C2
InChI=1SC13H15N3O3Sc11611(819106435710)141513(16)20912(17)182h37H89H212H3
methyl((4methyl5(phenoxymethyl)4H124triazol3yl)sulfanyl)acetate
METHYL2((4METHYL5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(4METHYL5(PHENOXYMETHYL)124TRIAZOL3YLTHIO)ACETATE
MFCD02091604
ZINC000000420596
ZINC00420596
ZINC420596

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Available files

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