Vitas-M small molecule compound
ethyl 6-(2-ethoxy-3-methoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK104021
SMILES CCOC(=O)C1=C(C)N=C(NC1c1cccc(c1OCC)OC)S
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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 C17H22N2O4S MW 350.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O4S/c1-5-22-15-11(8-7-9-12(15)21-4)14-13(16(20)23-6-2)10(3)18-17(24)19-14/h7-9,14H,5-6H2,1-4H3,(H2,18,19,24)InChIKey
RUNCBGLRYUZLJK-UHFFFAOYSA-NSynonyms
CCOC1=C(C=CC=C1OC)C2C(=C(NC(=S)N2)C)C(=O)OCC
ETHYL4(2ETHOXY3METHOXYPHENYL)6METHYL2SULFANYL34DIHYDROPYRIMIDINE5CARBOXYLATE
ETHYL4(2ETHOXY3METHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL6(2ETHOXY3METHOXYPHENYL)4METHYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC17H22N2O4Sc15221511(87912(15)214)1413(16(20)2362)10(3)1817(24)1914h7914H56H214H3(H2181924)
MFCD03716027
ZINC000005408506
ZINC000005408508
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