Vitas-M small molecule compound
9-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STL396834
SMILES O=C1CCCC2=C1C(C1=C(O2)CCCC1=O)c1c(C)nn(c1C)c1ccccc1
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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 C24H24N2O3 MW 388.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O3/c1-14-21(15(2)26(25-14)16-8-4-3-5-9-16)24-22-17(27)10-6-12-19(22)29-20-13-7-11-18(28)23(20)24/h3-5,8-9,24H,6-7,10-13H2,1-2H3InChIKey
QBWNOWOLKAFVAQ-UHFFFAOYSA-NSynonyms
1006316-03-51006316035
9(35dimethyl1phenyl1Hpyrazol4yl)345679hexahydro1Hxanthene18(2H)dione
9(35dimethyl1phenylpyrazol4yl)345679hexahydro2Hxanthene18dione
CC1=C(C(=NN1C2=CC=CC=C2)C)C3C4=C(CCCC4=O)OC5=C3C(=O)CCC5
InChI=1SC24H24N2O3c11421(15(2)26(2514)168435916)242217(27)1061219(22)29201371118(28)23(20)24h358924H671013H212H3
MFCD08555861
ZINC000020607388
ZINC20607388
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