Vitas-M small molecule compound

5-{[(4,6-diaminopyrimidin-2-yl)sulfanyl]methyl}-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STL079534
SMILES Nc1cc(N)nc(n1)SCc1n[nH]c(=S)n1C

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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 C8H11N7S2 MW 269.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11N7S2/c1-15-6(13-14-8(15)16)3-17-7-11-4(9)2-5(10)12-7/h2H,3H2,1H3,(H,14,16)(H4,9,10,11,12)
InChIKey
BPXHBDQWSIDQQP-UHFFFAOYSA-N
Synonyms

3(((46DIAMINOPYRIMIDIN2YL)THIO)METHYL)4METHYL1H124TRIAZOLE5(4H)THIONE
3((46DIAMINOPYRIMIDIN2YL)SULFANYLMETHYL)4METHYL1H124TRIAZOLE5THIONE
3((46DIAMINOPYRIMIDIN2YLTHIO)METHYL)4METHYL124TRIAZOLINE5THIONE
5(((46diaminopyrimidin2yl)sulfanyl)methyl)4methyl24dihydro3H124triazole3thione
CN1C(=NNC1=S)CSC2=NC(=CC(=N2)N)N
InChI=1SC8H11N7S2c1156(13148(15)16)3177114(9)25(10)127h2H3H21H3(H1416)(H49101112)
MFCD06405650
Nc1cc(N)nc(n1)SCc1n(nH)c(=S)n1C
ZINC000002710656
ZINC2710656

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Available files

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