Vitas-M small molecule compound

2-[5,7-bis(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
STL234836
SMILES COc1ccc(cc1)C1CC(Nc2n1nc(n2)N1C(=O)C2C(C1=O)CC=CC2)c1ccc(cc1)OC

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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 C27H27N5O4 MW 485.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O4/c1-35-18-11-7-16(8-12-18)22-15-23(17-9-13-19(36-2)14-10-17)32-26(28-22)29-27(30-32)31-24(33)20-5-3-4-6-21(20)25(31)34/h3-4,7-14,20-23H,5-6,15H2,1-2H3,(H,28,29,30)
InChIKey
GVTLANPTDJRFMC-UHFFFAOYSA-N
Synonyms
1024524-15-9
1024524159
2(57bis(4methoxyphenyl)1567tetrahydro(124)triazolo(15a)pyrimidin2yl)3a477atetrahydroisoindole13dione
2(57bis(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)OC
InChI=1SC27H27N5O4c1351811716(81218)221523(1791319(362)141017)3226(2822)2927(3032)3124(33)20534621(20)25(31)34h347142023H5615H212H3(H282930)
MFCD05699857
ZINC000009344890
ZINC000248184735

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Available files

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