Vitas-M small molecule compound
cyclohexyl 5-methyl-7-(2,3,4-trimethoxyphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK914913
SMILES COc1c(OC)c(OC)ccc1C1C(=C(C)Nc2n1ncn2)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 C22H28N4O5 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O5/c1-13-17(21(27)31-14-8-6-5-7-9-14)18(26-22(25-13)23-12-24-26)15-10-11-16(28-2)20(30-4)19(15)29-3/h10-12,14,18H,5-9H2,1-4H3,(H,23,24,25)InChIKey
FHPLBXDIUWKIQM-UHFFFAOYSA-NSynonyms
CC1=C(C(N2C(=N1)N=CN2)C3=C(C(=C(C=C3)OC)OC)OC)C(=O)OC4CCCCC4
CYCLOHEXYL5METHYL7(234TRIMETHOXYPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
cyclohexyl5methyl7(234trimethoxyphenyl)47dihydro(124)triazolo(15a)pyrimidine6carboxylate
InChI=1SC22H28N4O5c11317(21(27)31148657914)18(2622(2513)23122426)15101116(282)20(304)19(15)293h10121418H59H214H3(H232425)
MFCD14725162
ZINC000008661278
ZINC000020117102
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