Vitas-M small molecule compound

(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl [(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate

Catalog ID
STK123810
SMILES CCn1c2ccccc2c2c1nc(SCC(=O)OCN1C(=O)c3c(C1=O)cccc3)nn2

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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 C22H17N5O4S MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N5O4S/c1-2-26-16-10-6-5-9-15(16)18-19(26)23-22(25-24-18)32-11-17(28)31-12-27-20(29)13-7-3-4-8-14(13)21(27)30/h3-10H,2,11-12H2,1H3
InChIKey
HUHWHIIFALZXTI-UHFFFAOYSA-N
Synonyms
350844-92-7
(13DIOXO13DIHYDRO2HISOINDOL2YL)METHYL((5ETHYL5H(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETATE
(13DIOXOISOINDOL2YL)METHYL2((5ETHYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETATE
350844927
CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC(=O)OCN4C(=O)C5=CC=CC=C5C4=O
InChI=1SC22H17N5O4Sc1226161065915(16)1819(26)2322(252418)321117(28)31122720(29)13734814(13)21(27)30h310H21112H21H3
MFCD02208007
ZINC000001196780
ZINC01196780
ZINC1196780

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Available files

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