Vitas-M small molecule compound
5-{[7-(4-chlorophenyl)-5-phenyl-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-5-oxopentanoic acid
Catalog ID
STK653520
SMILES O=C(Nc1nn2c(=NC(=CC2c2ccc(cc2)Cl)c2ccccc2)[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/c23-16-11-9-15(10-12-16)18-13-17(14-5-2-1-3-6-14)24-22-26-21(27-28(18)22)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
UIIOLYLFFBIKMD-UHFFFAOYSA-NSynonyms
799828-91-45((7(4CHLOROPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)AMINO)5OXOPENTANOICACID
5((7(4chlorophenyl)5phenyl37dihydro(124)triazolo(15a)pyrimidin2yl)amino)5oxopentanoicacid
799828914
C1=CC=C(C=C1)C2=CC(N3C(=N2)N=C(N3)NC(=O)CCCC(=O)O)C4=CC=C(C=C4)Cl
InChI=1SC22H20ClN5O3c231611915(101216)181317(145213614)24222621(2728(18)22)2519(29)74820(30)31h135691318H478H2(H3031)(H22425262729)
MFCD18166725
O=C(Nc1nn2c(=NC(=CC2c2ccc(cc2)Cl)c2ccccc2)(nH)1)CCCC(=O)O
ZINC000002245030
ZINC000002245031
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