Vitas-M small molecule compound

tert-butyl 3-thioxopiperazine-1-carboxylate

Catalog ID
STL193391
SMILES S=C1NCCN(C1)C(=O)OC(C)(C)C

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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 C9H16N2O2S MW 216.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H16N2O2S/c1-9(2,3)13-8(12)11-5-4-10-7(14)6-11/h4-6H2,1-3H3,(H,10,14)
InChIKey
NDQGYAYVFMSQSU-UHFFFAOYSA-N
Synonyms
1182359-40-5
1182359405
CC(C)(C)OC(=O)N1CCNC(=S)C1
InChI=1SC9H16N2O2Sc19(23)138(12)1154107(14)611h46H213H3(H1014)
MFCD19105267
tertbutyl3sulfanylidenepiperazine1carboxylate
tertbutyl3thioxopiperazine1carboxylate
ZINC000072333522
ZINC72333522

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Available files

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