Vitas-M small molecule compound
methyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(2-ethoxyphenyl)-2-hydroxy-3,4-dihydropyridine-3-carboxylate
Catalog ID
STK583458
SMILES CCOc1ccccc1C1C(C(=O)OC)C(=NC(=C1C#N)SCC(=O)N)O
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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 C18H19N3O5S MW 389.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O5S/c1-3-26-12-7-5-4-6-10(12)14-11(8-19)17(27-9-13(20)22)21-16(23)15(14)18(24)25-2/h4-7,14-15H,3,9H2,1-2H3,(H2,20,22)(H,21,23)InChIKey
UHSGIZIMIHBINJ-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)N)C(=O)OC
InChI=1SC18H19N3O5Sc132612754610(12)1411(819)17(27913(20)22)2116(23)15(14)18(24)252h471415H39H212H3(H22022)(H2123)
methyl6((2amino2oxoethyl)sulfanyl)5cyano4(2ethoxyphenyl)2hydroxy34dihydropyridine3carboxylate
METHYL6(2AMINO2OXOETHYL)SULFANYL5CYANO4(2ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
METHYL6(CARBAMOYLMETHYLTHIO)5CYANO4(2ETHOXYPHENYL)2OXO134TRIHYDROPYRIDINE3CARBOXYLATE
MFCD07197905
ZINC000009329858
ZINC000009374190
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