Vitas-M small molecule compound
ethyl 6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-4-(2-methylpropyl)-1,4-dihydropyridine-3-carboxylate
Catalog ID
STK891206
SMILES CCOC(=O)C1=C(C)NC(=C(C1CC(C)C)C#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 C16H23N3O3S MW 337.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O3S/c1-5-22-16(21)14-10(4)19-15(23-8-13(18)20)12(7-17)11(14)6-9(2)3/h9,11,19H,5-6,8H2,1-4H3,(H2,18,20)InChIKey
NAGYXXCIPOAVIQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=C(C1CC(C)C)C#N)SCC(=O)N)C
ethyl6((2amino2oxoethyl)sulfanyl)5cyano2methyl4(2methylpropyl)14dihydropyridine3carboxylate
ETHYL6(2AMINO2OXOETHYL)SULFANYL5CYANO2METHYL4(2METHYLPROPYL)14DIHYDROPYRIDINE3CARBOXYLATE
InChI=1SC16H23N3O3Sc152216(21)1410(4)1915(23813(18)20)12(717)11(14)69(2)3h91119H568H214H3(H21820)
MFCD01558668
ZINC000000278430
ZINC000020533522
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