Vitas-M small molecule compound

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

Catalog ID
STK478683
SMILES CCOC(=O)CSc1nnc(n1CC)c1ccccc1C

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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 C15H19N3O2S MW 305.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N3O2S/c1-4-18-14(12-9-7-6-8-11(12)3)16-17-15(18)21-10-13(19)20-5-2/h6-9H,4-5,10H2,1-3H3
InChIKey
CPPNSLLXPMLGSE-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)OCC)C2=CC=CC=C2C
ethyl((4ethyl5(2methylphenyl)4H124triazol3yl)sulfanyl)acetate
ETHYL2((4ETHYL5(2METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ACETATE
ETHYL2(4ETHYL5(2METHYLPHENYL)124TRIAZOL3YLTHIO)ACETATE
InChI=1SC15H19N3O2Sc141814(12976811(12)3)161715(18)211013(19)2052h69H4510H213H3
MFCD06144684
ZINC000006727181
ZINC06727181
ZINC6727181

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Available files

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