Vitas-M small molecule compound
cyclooctyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK075753
SMILES COc1cc(ccc1OCc1ccccc1)C1NC(=O)NC(=C1C(=O)OC1CCCCCCC1)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 C28H34N2O5 MW 478.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O5/c1-19-25(27(31)35-22-13-9-4-3-5-10-14-22)26(30-28(32)29-19)21-15-16-23(24(17-21)33-2)34-18-20-11-7-6-8-12-20/h6-8,11-12,15-17,22,26H,3-5,9-10,13-14,18H2,1-2H3,(H2,29,30,32)InChIKey
LRWQNVWGQLFBDO-UHFFFAOYSA-NSynonyms
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)C(=O)OC4CCCCCCC4
COc1cc(ccc1OCc1ccccc1)C1NC(=O)NC(=C1C(=O)OC1CCCCCCC1)C
CYCLOOCTYL4(3METHOXY4PHENYLMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
cyclooctyl4(4(benzyloxy)3methoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
CYCLOOCTYL6(3METHOXY4(PHENYLMETHOXY)PHENYL)4METHYL2OXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC28H34N2O5c11925(27(31)3522139435101422)26(3028(32)2919)21151623(24(1721)332)341820117681220h68111215172226H35910131418H212H3(H2293032)
MFCD01193091
STK075753
ZINC000000861177
ZINC000000861178
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