Vitas-M small molecule compound
5-{[7-(4-chlorophenyl)-5-phenyl-4,5,6,7-tetrahydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]amino}-5-oxopentanoic acid
Catalog ID
STL345343
SMILES O=C(Nc1nn2c(n1)NC(CC2c1ccc(cc1)Cl)c1ccccc1)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 C22H22ClN5O3 MW 439.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN5O3/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/h1-3,5-6,9-12,17-18H,4,7-8,13H2,(H,30,31)(H2,24,25,26,27,29)InChIKey
DWZCDLRADFOYPO-UHFFFAOYSA-NSynonyms
848061-46-15((7(4chlorophenyl)5phenyl1567tetrahydro(124)triazolo(15a)pyrimidin2yl)amino)5oxopentanoicacid
5((7(4chlorophenyl)5phenyl4567tetrahydro(124)triazolo(15a)pyrimidin2yl)amino)5oxopentanoicacid
848061461
C1C(N=C2N=C(NN2C1C3=CC=C(C=C3)Cl)NC(=O)CCCC(=O)O)C4=CC=CC=C4
InChI=1SC22H22ClN5O3c231611915(101216)181317(145213614)24222621(2728(18)22)2519(29)74820(30)31h13569121718H47813H2(H3031)(H22425262729)
MFCD04186996
ZINC000038201837
ZINC000038201840
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