Vitas-M small molecule compound

methyl {3-[(2-methoxy-2-oxoethyl)sulfanyl]-5H-[1,2,4]triazino[5,6-b]indol-5-yl}acetate

Catalog ID
STK395249
SMILES COC(=O)CSc1nnc2c(n1)n(CC(=O)OC)c1c2cccc1

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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 C15H14N4O4S MW 346.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O4S/c1-22-11(20)7-19-10-6-4-3-5-9(10)13-14(19)16-15(18-17-13)24-8-12(21)23-2/h3-6H,7-8H2,1-2H3
InChIKey
XGSKMXMPNOEPGH-UHFFFAOYSA-N
Synonyms

COC(=O)CN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)OC
InChI=1SC15H14N4O4Sc12211(20)7191064359(10)1314(19)1615(181713)24812(21)232h36H78H212H3
methyl(3((2methoxy2oxoethyl)sulfanyl)5H(124)triazino(56b)indol5yl)acetate
METHYL2(3((METHOXYCARBONYL)METHYLTHIO)124TRIAZINO(56B)INDOL5YL)ACETATE
METHYL2(3(2METHOXY2OXOETHYL)SULFANYL(124)TRIAZINO(56B)INDOL5YL)ACETATE
MFCD02737510
ZINC000000377043
ZINC00377043
ZINC377043

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Available files

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