Vitas-M small molecule compound
2-phenylethyl 4-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK371681
SMILES COc1ccc(c(c1)C1NC(=S)NC(=C1C(=O)OCCc1ccccc1)C)OC
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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 C22H24N2O4S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4S/c1-14-19(21(25)28-12-11-15-7-5-4-6-8-15)20(24-22(29)23-14)17-13-16(26-2)9-10-18(17)27-3/h4-10,13,20H,11-12H2,1-3H3,(H2,23,24,29)InChIKey
BUUUMENGVARQCA-UHFFFAOYSA-NSynonyms
2phenylethyl4(25dimethoxyphenyl)6methyl2sulfanylidene34dihydro1Hpyrimidine5carboxylate
2phenylethyl4(25dimethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
2PHENYLETHYL6(25DIMETHOXYPHENYL)4METHYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=S)N1)C2=C(C=CC(=C2)OC)OC)C(=O)OCCC3=CC=CC=C3
InChI=1SC22H24N2O4Sc11419(21(25)281211157546815)20(2422(29)2314)171316(262)91018(17)273h4101320H1112H213H3(H2232429)
MFCD00337150
PHENETHYL4(25DIMETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ZINC000000823633
ZINC000000823634
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