Vitas-M small molecule compound
propan-2-yl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK081477
SMILES COc1cc(cc(c1O)Cl)C1NC(=O)NC(=C1C(=O)OC(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 C16H19ClN2O5 MW 354.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19ClN2O5/c1-7(2)24-15(21)12-8(3)18-16(22)19-13(12)9-5-10(17)14(20)11(6-9)23-4/h5-7,13,20H,1-4H3,(H2,18,19,22)InChIKey
VTCOWANFFVHOAV-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)Cl)O)OC)C(=O)OC(C)C
COc1cc(cc(c1O)Cl)C1NC(=O)NC(=C1C(=O)OC(C)C)C
InChI=1SC16H19ClN2O5c17(2)2415(21)128(3)1816(22)1913(12)9510(17)14(20)11(69)234h571320H14H3(H2181922)
METHYLETHYL6(3CHLORO4HYDROXY5METHOXYPHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
MFCD01192298
propan2yl4(3chloro4hydroxy5methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
PROPAN2YL4(3CHLORO4HYDROXY5METHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
STK081477
ZINC000001189627
ZINC000004121972
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