Vitas-M small molecule compound
ethyl 3-tert-butyl-8-cyano-3-hydroxy-7-[4-(methoxycarbonyl)phenyl]-5-methyl-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6-carboxylate
Catalog ID
STL057955
SMILES CCOC(=O)C1=C(C)N2C(=C(C1c1ccc(cc1)C(=O)OC)C#N)SCC2(O)C(C)(C)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 C24H28N2O5S MW 456.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O5S/c1-7-31-22(28)18-14(2)26-20(32-13-24(26,29)23(3,4)5)17(12-25)19(18)15-8-10-16(11-9-15)21(27)30-6/h8-11,19,29H,7,13H2,1-6H3InChIKey
LBIQUSKUSUEYSU-UHFFFAOYSA-NSynonyms
(3S7R)ethyl3(tertbutyl)8cyano3hydroxy7(4(methoxycarbonyl)phenyl)5methyl37dihydro2Hthiazolo(32a)pyridine6carboxylate
CCOC(=O)C1=C(C)N2C(=C((C@@H)1c1ccc(cc1)C(=O)OC)C#N)SC(C@@)2(O)C(C)(C)C
CCOC(=O)C1=C(N2C(=C(C1C3=CC=C(C=C3)C(=O)OC)C#N)SCC2(C(C)(C)C)O)C
ETHYL(3S7S)3TERTBUTYL8CYANO3HYDROXY7(4(METHOXYCARBONYL)PHENYL)5METHYL23DIHYDRO7H(13)THIAZOLO(32A)PYRIDINE6CARBOXYLATE
ethyl3tertbutyl8cyano3hydroxy7(4(methoxycarbonyl)phenyl)5methyl23dihydro7H(13)thiazolo(32a)pyridine6carboxylate
ETHYL3TERTBUTYL8CYANO3HYDROXY7(4METHOXYCARBONYLPHENYL)5METHYL27DIHYDRO(13)THIAZOLO(32A)PYRIDINE6CARBOXYLATE
InChI=1SC24H28N2O5Sc173122(28)1814(2)2620(321324(2629)23(34)5)17(1225)19(18)1581016(11915)21(27)306h8111929H713H216H3
MFCD18192870
ZINC000002231154
ZINC000006498649
Check stock
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