Vitas-M small molecule compound
6-cyclohexyl 2-methyl 7-(4-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-2,6-dicarboxylate
Catalog ID
STL193248
SMILES COc1ccc(cc1)C1C(=C(C)Nc2n1nc(n2)C(=O)OC)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 C22H26N4O5 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O5/c1-13-17(20(27)31-16-7-5-4-6-8-16)18(14-9-11-15(29-2)12-10-14)26-22(23-13)24-19(25-26)21(28)30-3/h9-12,16,18H,4-8H2,1-3H3,(H,23,24,25)InChIKey
AYICEYOPOFVPMU-UHFFFAOYSA-NSynonyms
6cyclohexyl2methyl7(4methoxyphenyl)5methyl47dihydro(124)triazolo(15a)pyrimidine26dicarboxylate
6OCYCLOHEXYL2OMETHYL7(4METHOXYPHENYL)5METHYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE26DICARBOXYLATE
CC1=C(C(N2C(=N1)N=C(N2)C(=O)OC)C3=CC=C(C=C3)OC)C(=O)OC4CCCCC4
InChI=1SC22H26N4O5c11317(20(27)31167546816)18(1491115(292)121014)2622(2313)2419(2526)21(28)303h9121618H48H213H3(H232425)
MFCD14725166
ZINC000020117117
ZINC000020117119
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