Vitas-M small molecule compound
ethyl 2-amino-5-cyano-6-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}pyridine-3-carboxylate
Catalog ID
STK239440
SMILES CCOC(=O)c1cc(C#N)c(nc1N)SCC(=O)NC1CCCC1
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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 C16H20N4O3S MW 348.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O3S/c1-2-23-16(22)12-7-10(8-17)15(20-14(12)18)24-9-13(21)19-11-5-3-4-6-11/h7,11H,2-6,9H2,1H3,(H2,18,20)(H,19,21)InChIKey
YUCWAZSFFSODCT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NC2CCCC2)N
ethyl2amino5cyano6((2(cyclopentylamino)2oxoethyl)sulfanyl)pyridine3carboxylate
ETHYL2AMINO5CYANO6(2(CYCLOPENTYLAMINO)2OXOETHYL)SULFANYLPYRIDINE3CARBOXYLATE
InChI=1SC16H20N4O3Sc122316(22)12710(817)15(2014(12)18)24913(21)1911534611h711H269H21H3(H21820)(H1921)
MFCD04055791
ZINC000018227572
ZINC18227572
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