Vitas-M small molecule compound

ethyl {[5-(prop-2-en-1-yl)-5H-[1,2,4]triazino[5,6-b]indol-3-yl]sulfanyl}acetate

Catalog ID
STK720042
SMILES CCOC(=O)CSc1nnc2c(n1)n(CC=C)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 C16H16N4O2S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S/c1-3-9-20-12-8-6-5-7-11(12)14-15(20)17-16(19-18-14)23-10-13(21)22-4-2/h3,5-8H,1,4,9-10H2,2H3
InChIKey
LTKFBJLHOUDWGT-UHFFFAOYSA-N
Synonyms
309268-31-3
309268313
CCOC(=O)CSC1=NC2=C(C3=CC=CC=C3N2CC=C)N=N1
ethyl((5(prop2en1yl)5H(124)triazino(56b)indol3yl)sulfanyl)acetate
ETHYL2((5PROP2ENYL(124)TRIAZINO(56B)INDOL3YL)SULFANYL)ACETATE
InChI=1SC16H16N4O2Sc1392012865711(12)1415(20)1716(191814)231013(21)2242h358H14910H22H3
MFCD01819666
ZINC000000080169
ZINC00080169
ZINC80169

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Available files

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