Vitas-M small molecule compound
2-[7-(4-fluorophenyl)-5-(4-methoxyphenyl)-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STL342671
SMILES COc1ccc(cc1)C1Nc2nc(nn2C(C1)c1ccc(cc1)F)N1C(=O)C2C(C1=O)CC=CC2
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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 C26H24FN5O3 MW 473.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24FN5O3/c1-35-18-12-8-15(9-13-18)21-14-22(16-6-10-17(27)11-7-16)32-25(28-21)29-26(30-32)31-23(33)19-4-2-3-5-20(19)24(31)34/h2-3,6-13,19-22H,4-5,14H2,1H3,(H,28,29,30)InChIKey
PLTMZYFNWVYZGZ-UHFFFAOYSA-NSynonyms
1212306-46-11212306461
2(7(4fluorophenyl)5(4methoxyphenyl)1567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydroisoindole13dione
2(7(4fluorophenyl)5(4methoxyphenyl)4567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydro1Hisoindole13(2H)dione
COC1=CC=C(C=C1)C2CC(N3C(=N2)N=C(N3)N4C(=O)C5CC=CCC5C4=O)C6=CC=C(C=C6)F
InChI=1SC26H24FN5O3c1351812815(91318)211422(1661017(27)11716)3225(2821)2926(3032)3123(33)19423520(19)24(31)34h236131922H4514H21H3(H282930)
MFCD04157680
ZINC000013758573
ZINC000245311643
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