Vitas-M small molecule compound
6-cyclohexyl 2-methyl 7-(3,4-dimethoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-2,6-dicarboxylate
Catalog ID
STL193251
SMILES COC(=O)c1nc2n(n1)C(c1ccc(c(c1)OC)OC)C(=C(N2)C)C(=O)OC1CCCCC1
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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)33-15-8-6-5-7-9-15)19(14-10-11-16(30-2)17(12-14)31-3)27-23(24-13)25-20(26-27)22(29)32-4/h10-12,15,19H,5-9H2,1-4H3,(H,24,25,26)InChIKey
SKDPYMIYKJSZTM-UHFFFAOYSA-NSynonyms
6cyclohexyl2methyl7(34dimethoxyphenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine26dicarboxylate
6OCYCLOHEXYL2OMETHYL7(34DIMETHOXYPHENYL)5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE26DICARBOXYLATE
CC1=C(C(N2C(=N1)N=C(N2)C(=O)OC)C3=CC(=C(C=C3)OC)OC)C(=O)OC4CCCCC4
InChI=1SC23H28N4O6c11318(21(28)33158657915)19(14101116(302)17(1214)313)2723(2413)2520(2627)22(29)324h10121519H59H214H3(H242526)
MFCD14725167
ZINC000013750107
ZINC000018066488
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