Vitas-M small molecule compound

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

Catalog ID
STK437226
SMILES CCOC(=O)CSc1nnc(n1CC=C)c1csc(c1)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 C15H19N3O2S2 MW 337.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19N3O2S2/c1-4-7-18-14(11-8-12(5-2)21-9-11)16-17-15(18)22-10-13(19)20-6-3/h4,8-9H,1,5-7,10H2,2-3H3
InChIKey
VSKJOQBGUNAEEC-UHFFFAOYSA-N
Synonyms

CCC1=CC(=CS1)C2=NN=C(N2CC=C)SCC(=O)OCC
ethyl((5(5ethylthiophen3yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetate
ETHYL2((5(5ETHYLTHIOPHEN3YL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETATE
ETHYL2(5(5ETHYL(3THIENYL))4PROP2ENYL124TRIAZOL3YLTHIO)ACETATE
InChI=1SC15H19N3O2S2c1471814(11812(52)21911)161715(18)221013(19)2063h489H15710H223H3
MFCD03944584
ZINC000005950085
ZINC05950085
ZINC5950085

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Available files

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