Vitas-M small molecule compound
ethyl 5-(1,3-benzodioxol-5-yl)-7-methyl-2-(methylsulfanyl)-4-oxo-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Catalog ID
STK980922
SMILES CCOC(=O)C1=C(C)Nc2c(C1c1ccc3c(c1)OCO3)c(=O)[nH]c(n2)SC
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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 C19H19N3O5S MW 401.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O5S/c1-4-25-18(24)13-9(2)20-16-15(17(23)22-19(21-16)28-3)14(13)10-5-6-11-12(7-10)27-8-26-11/h5-7,14H,4,8H2,1-3H3,(H2,20,21,22,23)InChIKey
RKQMUNFBODQZGJ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)Nc2c(C1c1ccc3c(c1)OCO3)c(=O)(nH)c(n2)SC
CCOC(=O)C1=C(NC2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)N=C(N2)SC)C
ethyl5(13benzodioxol5yl)7methyl2(methylsulfanyl)4oxo3458tetrahydropyrido(23d)pyrimidine6carboxylate
ethyl5(13benzodioxol5yl)7methyl2methylsulfanyl4oxo58dihydro1Hpyrido(23d)pyrimidine6carboxylate
InChI=1SC19H19N3O5Sc142518(24)139(2)201615(17(23)2219(2116)283)14(13)10561112(710)2782611h5714H48H213H3(H220212223)
MFCD18181251
ZINC000028466764
ZINC000028466768
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