Vitas-M small molecule compound

1-(3-thioxodiaziridin-1-yl)-2-(4H-1,2,4-triazol-3-ylsulfanyl)ethanone

Catalog ID
STK644987
SMILES C(C(=O)N1NC1=S)Sc1nnc[nH]1

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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 C5H5N5OS2 MW 215.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H5N5OS2/c11-3(10-5(12)9-10)1-13-4-6-2-7-8-4/h2H,1H2,(H,9,12)(H,6,7,8)
InChIKey
OTPDSEAEZCPVSF-UHFFFAOYSA-N
Synonyms
951948-51-9
1(3sulfanylidenediaziridin1yl)2(1H124triazol5ylsulfanyl)ethanone
1(3thioxodiaziridin1yl)2(4H124triazol3ylsulfanyl)ethanone
2((1H124triazol3yl)thio)1(3thioxodiaziridin1yl)ethanone
951948519
C(C(=O)N1NC1=S)Sc1nnc(nH)1
C1=NNC(=N1)SCC(=O)N2C(=S)N2
InChI=1SC5H5N5OS2c113(105(12)910)113462784h2H1H2(H912)(H678)
MFCD18163789
O=C(N1NC1=S)CSc1n(nH)cn1
ZINC000013692721
ZINC13692721

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Available files

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