Vitas-M small molecule compound
9-[1-(3,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK675170
SMILES O=C1CC(C)(C)CC2=C1C(C1=C(O2)CC(CC1=O)(C)C)c1cn(nc1c1ccccc1)Cc1ccc(c(c1)Cl)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 C33H32Cl2N2O3 MW 575.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H32Cl2N2O3/c1-32(2)13-24(38)29-26(15-32)40-27-16-33(3,4)14-25(39)30(27)28(29)21-18-37(17-19-10-11-22(34)23(35)12-19)36-31(21)20-8-6-5-7-9-20/h5-12,18,28H,13-17H2,1-4H3InChIKey
GWDOXUIVANHIQV-UHFFFAOYSA-NSynonyms
9(1((34dichlorophenyl)methyl)3phenylpyrazol4yl)3366tetramethyl4579tetrahydro2Hxanthene18dione
9(1(34dichlorobenzyl)3phenyl1Hpyrazol4yl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CN(N=C4C5=CC=CC=C5)CC6=CC(=C(C=C6)Cl)Cl)C(=O)C1)C
InChI=1SC33H32Cl2N2O3c132(2)1324(38)2926(1532)40271633(34)1425(39)30(27)28(29)211837(1719101122(34)23(35)1219)3631(21)208657920h5121828H1317H214H3
MFCD01572892
ZINC000002190012
ZINC02190012
ZINC2190012
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