Vitas-M small molecule compound
cyclohexylmethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK046289
SMILES COc1cc(ccc1OC)C1NC(=O)NC(=C1C(=O)OCC1CCCCC1)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 C21H28N2O5 MW 388.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O5/c1-13-18(20(24)28-12-14-7-5-4-6-8-14)19(23-21(25)22-13)15-9-10-16(26-2)17(11-15)27-3/h9-11,14,19H,4-8,12H2,1-3H3,(H2,22,23,25)InChIKey
NXIFAGSMRPHYTK-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC3CCCCC3
COc1cc(ccc1OC)C1NC(=O)NC(=C1C(=O)OCC1CCCCC1)C
cyclohexylmethyl4(34dimethoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOHEXYLMETHYL4(34DIMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC21H28N2O5c11318(20(24)2812147546814)19(2321(25)2213)1591016(262)17(1115)273h9111419H4812H213H3(H2222325)
MFCD01192418
STK046289
ZINC000000706361
ZINC000000706362
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