Vitas-M small molecule compound

5-{[5-(4-chlorophenyl)-7-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-5-oxopentanoic acid

Catalog ID
STL045609
SMILES O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)[nH]1)CCCC(=O)O

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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 C22H20ClN5O3 MW 437.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O3/c23-16-11-9-14(10-12-16)17-13-18(15-5-2-1-3-6-15)28-22(24-17)26-21(27-28)25-19(29)7-4-8-20(30)31/h1-3,5-6,9-13,18H,4,7-8H2,(H,30,31)(H2,24,25,26,27,29)
InChIKey
UCMBQWRUNNXRKS-UHFFFAOYSA-N
Synonyms
488851-36-1
488851361
5((5(4CHLOROPHENYL)7PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)AMINO)5OXOPENTANOICACID
5((5(4chlorophenyl)7phenyl37dihydro(124)triazolo(15a)pyrimidin2yl)amino)5oxopentanoicacid
C1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)NC(=O)CCCC(=O)O)C4=CC=C(C=C4)Cl
InChI=1SC22H20ClN5O3c231611914(101216)171318(155213615)2822(2417)2621(2728)2519(29)74820(30)31h135691318H478H2(H3031)(H22425262729)
MFCD03797775
O=C(Nc1nn2c(=NC(=CC2c2ccccc2)c2ccc(cc2)Cl)(nH)1)CCCC(=O)O
ZINC000001902170
ZINC000001902171

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Available files

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