Vitas-M small molecule compound
ethyl 6-[(benzylsulfanyl)methyl]-4-(2,5-dimethylphenyl)-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK775586
SMILES CCOC(=O)C1=C(CSCc2ccccc2)NC(=O)NC1c1cc(C)ccc1C
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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 C23H26N2O3S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O3S/c1-4-28-22(26)20-19(14-29-13-17-8-6-5-7-9-17)24-23(27)25-21(20)18-12-15(2)10-11-16(18)3/h5-12,21H,4,13-14H2,1-3H3,(H2,24,25,27)InChIKey
SKMIDQQQVAUFQQ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NC(=O)NC1C2=C(C=CC(=C2)C)C)CSCC3=CC=CC=C3
ethyl6((benzylsulfanyl)methyl)4(25dimethylphenyl)2oxo1234tetrahydropyrimidine5carboxylate
ETHYL6(25DIMETHYLPHENYL)2OXO4((PHENYLMETHYLTHIO)METHYL)136TRIHYDROPYRIMIDINE5CARBOXYLATE
ETHYL6(BENZYLSULFANYLMETHYL)4(25DIMETHYLPHENYL)2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC23H26N2O3Sc142822(26)2019(142913178657917)2423(27)2521(20)181215(2)101116(18)3h51221H41314H213H3(H2242527)
MFCD05257560
ZINC000001058681
ZINC000001058683
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