Vitas-M small molecule compound
methyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-4-(4-ethoxyphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
Catalog ID
STK543278
SMILES CCOc1ccc(cc1)C1C(C(=O)OC)C(=O)NC(=C1C#N)SCC(=O)N
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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/c1-3-26-11-6-4-10(5-7-11)14-12(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
AYRIKGODJLUGJR-UHFFFAOYSA-NSynonyms
361478-33-3361478333
CCOC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)N)C(=O)OC
InChI=1SC18H19N3O5Sc1326116410(5711)1412(819)17(27913(20)22)2116(23)15(14)18(24)252h471415H39H212H3(H22022)(H2123)
methyl6((2amino2oxoethyl)sulfanyl)5cyano4(4ethoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
methyl6((2amino2oxoethyl)thio)5cyano4(4ethoxyphenyl)2oxo1234tetrahydropyridine3carboxylate
METHYL6(2AMINO2OXOETHYL)SULFANYL5CYANO4(4ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDINE3CARBOXYLATE
MFCD03296268
ZINC000008970623
ZINC000008970631
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