Vitas-M small molecule compound
tert-butyl 5-cyano-6-hydroxy-2-methyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK957099
SMILES N#CC1=C(O)NC(=C(C1c1cccs1)C(=O)OC(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 C16H18N2O3S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O3S/c1-9-12(15(20)21-16(2,3)4)13(11-6-5-7-22-11)10(8-17)14(19)18-9/h5-7,13,18-19H,1-4H3InChIKey
NTEXFAZGKRERCU-UHFFFAOYSA-NSynonyms
CC1=C(C(C(=C(N1)O)C#N)C2=CC=CS2)C(=O)OC(C)(C)C
InChI=1SC16H18N2O3Sc1912(15(20)2116(23)4)13(116572211)10(817)14(19)189h57131819H14H3
MFCD01417339
TERTBUTYL5CYANO6HYDROXY2METHYL4(2THIENYL)14DIHYDROPYRIDINE3CARBOXYLATE
tertbutyl5cyano6hydroxy2methyl4(thiophen2yl)14dihydropyridine3carboxylate
TERTBUTYL5CYANO6HYDROXY2METHYL4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXYLATE
ZINC000002729080
ZINC000023379243
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