Vitas-M small molecule compound

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

Catalog ID
STK807277
SMILES COC(=O)CSc1nnc(n1CC)COc1ccc2c(c1)OCO2

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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 C15H17N3O5S MW 351.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O5S/c1-3-18-13(16-17-15(18)24-8-14(19)20-2)7-21-10-4-5-11-12(6-10)23-9-22-11/h4-6H,3,7-9H2,1-2H3
InChIKey
GWHRJOQWSCLCQZ-UHFFFAOYSA-N
Synonyms

CCN1C(=NN=C1SCC(=O)OC)COC2=CC3=C(C=C2)OCO3
InChI=1SC15H17N3O5Sc131813(161715(18)24814(19)202)72110451112(610)2392211h46H379H212H3
methyl((5((13benzodioxol5yloxy)methyl)4ethyl4H124triazol3yl)sulfanyl)acetate
METHYL2((5((BENZO(D)(13)DIOXOL5YLOXY)METHYL)4ETHYL4H124TRIAZOL3YL)THIO)ACETATE
METHYL2((5(13BENZODIOXOL5YLOXYMETHYL)4ETHYL124TRIAZOL3YL)SULFANYL)ACETATE
METHYL2(5(2HBENZO(34D)13DIOXOLEN5YLOXYMETHYL)4ETHYL124TRIAZOL3YLTHIO)ACETATE
MFCD03837975
ZINC000002692981
ZINC02692981
ZINC2692981

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Available files

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