Vitas-M small molecule compound

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

Catalog ID
STK481957
SMILES CCCn1c(SCC(=O)OC)nnc1c1ccco1

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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 C12H15N3O3S MW 281.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O3S/c1-3-6-15-11(9-5-4-7-18-9)13-14-12(15)19-8-10(16)17-2/h4-5,7H,3,6,8H2,1-2H3
InChIKey
GDIJUHCLIYRAPQ-UHFFFAOYSA-N
Synonyms

CCCN1C(=NN=C1SCC(=O)OC)C2=CC=CO2
InChI=1SC12H15N3O3Sc1361511(9547189)131412(15)19810(16)172h457H368H212H3
methyl((5(furan2yl)4propyl4H124triazol3yl)sulfanyl)acetate
METHYL2((5(FURAN2YL)4PROPYL124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(5(2FURYL)4PROPYL124TRIAZOL3YLTHIO)ACETATE
MFCD06034067
ZINC000006742293
ZINC06742293
ZINC6742293

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Available files

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