Vitas-M small molecule compound
6-cyclohexyl 2-methyl 7-(2,5-dimethoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-2,6-dicarboxylate
Catalog ID
STK914916
SMILES COC(=O)c1nn2c(n1)NC(=C(C2c1cc(OC)ccc1OC)C(=O)OC1CCCCC1)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 C23H28N4O6 MW 456.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O6/c1-13-18(21(28)33-14-8-6-5-7-9-14)19(16-12-15(30-2)10-11-17(16)31-3)27-23(24-13)25-20(26-27)22(29)32-4/h10-12,14,19H,5-9H2,1-4H3,(H,24,25,26)InChIKey
XVWCXJSRFMACOL-UHFFFAOYSA-NSynonyms
6cyclohexyl2methyl7(25dimethoxyphenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine26dicarboxylate
6OCYCLOHEXYL2OMETHYL7(25DIMETHOXYPHENYL)5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE26DICARBOXYLATE
CC1=C(C(N2C(=N1)N=C(N2)C(=O)OC)C3=C(C=CC(=C3)OC)OC)C(=O)OC4CCCCC4
InChI=1SC23H28N4O6c11318(21(28)33148657914)19(161215(302)101117(16)313)2723(2413)2520(2627)22(29)324h10121419H59H214H3(H242526)
MFCD05031775
ZINC000017837198
ZINC000017885803
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