Vitas-M small molecule compound

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

Catalog ID
STK370569
SMILES CCN(CCSc1nnc2c(n1)n(CC(=O)N)c1c2cccc1)CC

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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 C17H22N6OS MW 358.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N6OS/c1-3-22(4-2)9-10-25-17-19-16-15(20-21-17)12-7-5-6-8-13(12)23(16)11-14(18)24/h5-8H,3-4,9-11H2,1-2H3,(H2,18,24)
InChIKey
HSBBYHGFIOBMGF-UHFFFAOYSA-N
Synonyms

2(3((2(diethylamino)ethyl)sulfanyl)5H(124)triazino(56b)indol5yl)acetamide
2(3(2(diethylamino)ethylsulfanyl)(124)triazino(56b)indol5yl)acetamide
2(3(2DIETHYLAMINOETHYLSULFANYL)(124)TRIAZINO(56B)INDOL5YL)ACETAMIDE
CCN(CC)CCSC1=NC2=C(C3=CC=CC=C3N2CC(=O)N)N=N1
InChI=1SC17H22N6OSc1322(42)9102517191615(202117)12756813(12)23(16)1114(18)24h58H34911H212H3(H21824)
MFCD00374717
ZINC000003068064
ZINC3068064

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Available files

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