Vitas-M small molecule compound

methyl ({1-[4-(dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]-1H-1,2,4-triazol-3-yl}sulfanyl)acetate

Catalog ID
STK857916
SMILES COC(=O)CSc1ncn(n1)c1nc(OC)nc(n1)N(C)C

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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 C11H15N7O3S MW 325.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N7O3S/c1-17(2)8-13-9(15-10(14-8)21-4)18-6-12-11(16-18)22-5-7(19)20-3/h6H,5H2,1-4H3
InChIKey
MCRRAOGTGGGOEQ-UHFFFAOYSA-N
Synonyms
898637-82-6
898637826
CN(C)C1=NC(=NC(=N1)N2C=NC(=N2)SCC(=O)OC)OC
InChI=1SC11H15N7O3Sc117(2)8139(1510(148)214)1861211(1618)2257(19)203h6H5H214H3
methyl((1(4(dimethylamino)6methoxy135triazin2yl)1H124triazol3yl)sulfanyl)acetate
methyl2((1(4(dimethylamino)6methoxy135triazin2yl)124triazol3yl)sulfanyl)acetate
methyl2((1(4(dimethylamino)6methoxy135triazin2yl)1H124triazol3yl)thio)acetate
MFCD12208438
ZINC000020733444
ZINC20733444

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Available files

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