Vitas-M small molecule compound
5-{[5-(4-chlorophenyl)-7-(4-methoxyphenyl)-3,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-5-oxopentanoic acid
Catalog ID
STK647765
SMILES COc1ccc(cc1)C1C=C(N=c2n1nc([nH]2)NC(=O)CCCC(=O)O)c1ccc(cc1)Cl
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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 C23H22ClN5O4 MW 467.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN5O4/c1-33-17-11-7-15(8-12-17)19-13-18(14-5-9-16(24)10-6-14)25-23-27-22(28-29(19)23)26-20(30)3-2-4-21(31)32/h5-13,19H,2-4H2,1H3,(H,31,32)(H2,25,26,27,28,30)InChIKey
DCZOGNKBUKFZBT-UHFFFAOYSA-NSynonyms
799831-22-45((5(4CHLOROPHENYL)7(4METHOXYPHENYL)17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDIN2YL)AMINO)5OXOPENTANOICACID
5((5(4chlorophenyl)7(4methoxyphenyl)37dihydro(124)triazolo(15a)pyrimidin2yl)amino)5oxopentanoicacid
799831224
COC1=CC=C(C=C1)C2C=C(N=C3N2NC(=N3)NC(=O)CCCC(=O)O)C4=CC=C(C=C4)Cl
COc1ccc(cc1)C1C=C(N=c2n1nc((nH)2)NC(=O)CCCC(=O)O)c1ccc(cc1)Cl
InChI=1SC23H22ClN5O4c1331711715(81217)191318(145916(24)10614)25232722(2829(19)23)2620(30)32421(31)32h51319H24H21H3(H3132)(H22526272830)
MFCD18164662
ZINC000002245859
ZINC000002245860
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