Vitas-M small molecule compound
3-methylbutyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1,6-dimethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK373584
SMILES COc1cc(cc(c1O)Cl)C1NC(=O)N(C(=C1C(=O)OCCC(C)C)C)C
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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 C19H25ClN2O5 MW 396.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25ClN2O5/c1-10(2)6-7-27-18(24)15-11(3)22(4)19(25)21-16(15)12-8-13(20)17(23)14(9-12)26-5/h8-10,16,23H,6-7H2,1-5H3,(H,21,25)InChIKey
SVHKRDIJWTUUEY-UHFFFAOYSA-NSynonyms
3methylbutyl4(3chloro4hydroxy5methoxyphenyl)16dimethyl2oxo1234tetrahydropyrimidine5carboxylate
3METHYLBUTYL6(3CHLORO4HYDROXY5METHOXYPHENYL)34DIMETHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
3METHYLBUTYL6(3CHLORO4HYDROXY5METHOXYPHENYL)34DIMETHYL2OXO16DIHYDROPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1C)C2=CC(=C(C(=C2)Cl)O)OC)C(=O)OCCC(C)C
InChI=1SC19H25ClN2O5c110(2)672718(24)1511(3)22(4)19(25)2116(15)12813(20)17(23)14(912)265h8101623H67H215H3(H2125)
MFCD00785453
ZINC000000728758
ZINC000000728759
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