Vitas-M small molecule compound
methyl 1-(2-ethoxyphenyl)-7-(furan-2-yl)-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Catalog ID
STL179348
SMILES CCOc1ccccc1n1c(S)nc(=O)c2c1nc(cc2C(=O)OC)c1ccco1
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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 C21H17N3O5S MW 423.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O5S/c1-3-28-16-8-5-4-7-14(16)24-18-17(19(25)23-21(24)30)12(20(26)27-2)11-13(22-18)15-9-6-10-29-15/h4-11H,3H2,1-2H3,(H,23,25,30)InChIKey
CCJAXULPHNPNLJ-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1N2C3=C(C(=CC(=N3)C4=CC=CO4)C(=O)OC)C(=O)NC2=S
InChI=1SC21H17N3O5Sc132816854714(16)241817(19(25)2321(24)30)12(20(26)272)1113(2218)1596102915h411H3H212H3(H232530)
methyl1(2ethoxyphenyl)7(furan2yl)4oxo2sulfanyl14dihydropyrido(23d)pyrimidine5carboxylate
methyl1(2ethoxyphenyl)7(furan2yl)4oxo2sulfanylidenepyrido(23d)pyrimidine5carboxylate
MFCD09472892
ZINC000020604082
ZINC20604082
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