Vitas-M small molecule compound
ethyl N-[2-(4-nitro-1H-pyrazol-1-yl)propanoyl]cysteinate
Catalog ID
STL394444
SMILES [O-][N+](=O)c1cn(nc1)C(C(=O)NC(C(=O)OCC)CS)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 C11H16N4O5S MW 316.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H16N4O5S/c1-3-20-11(17)9(6-21)13-10(16)7(2)14-5-8(4-12-14)15(18)19/h4-5,7,9,21H,3,6H2,1-2H3,(H,13,16)InChIKey
RZXUHVBNBRDOSW-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1cn(nc1)C(C(=O)NC(C(=O)OCC)CS)C
CCOC(=O)C(CS)NC(=O)C(C)N1C=C(C=N1)(N+)(=O)(O)
ethyl2(2(4nitropyrazol1yl)propanoylamino)3sulfanylpropanoate
ETHYLN(2(4NITRO1HPYRAZOL1YL)PROPANOYL)CYSTEINATE
InChI=1SC11H16N4O5Sc132011(17)9(621)1310(16)7(2)1458(41214)15(18)19h457921H36H212H3(H1316)
MFCD28952540
ZINC000006739801
ZINC000017053727
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