Vitas-M small molecule compound
methyl 5-cyano-4-(2-methylphenyl)-2-oxo-6-(prop-2-en-1-ylsulfanyl)-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK885724
SMILES C=CCSC1=C(C#N)C(C(C(=O)N1)C(=O)OC)c1ccccc1C
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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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-4-9-24-17-13(10-19)14(12-8-6-5-7-11(12)2)15(16(21)20-17)18(22)23-3/h4-8,14-15H,1,9H2,2-3H3,(H,20,21)InChIKey
HXTRQANFUURSHF-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC=C)C(=O)OC
InChI=1SC18H18N2O3Sc149241713(1019)14(12865711(12)2)15(16(21)2017)18(22)233h481415H19H223H3(H2021)
methyl5cyano4(2methylphenyl)2oxo6(prop2en1ylsulfanyl)1234tetrahydropyridine3carboxylate
METHYL5CYANO4(2METHYLPHENYL)2OXO6PROP2ENYLSULFANYL34DIHYDRO1HPYRIDINE3CARBOXYLATE
METHYL5CYANO4(2METHYLPHENYL)2OXO6PROP2ENYLTHIO134TRIHYDROPYRIDINE3CARBOXYLATE
methyl6(allylthio)5cyano2oxo4(otolyl)1234tetrahydropyridine3carboxylate
MFCD02232557
ZINC000002296626
ZINC000002296629
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