Vitas-M small molecule compound
9-(4-chloro-3-nitrophenyl)-10-(4-fluorophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Catalog ID
STK914500
SMILES Fc1ccc(cc1)N1C2=C(C(=O)CC(C2)(C)C)C(C2=C1CC(C)(C)CC2=O)c1ccc(c(c1)[N+](=O)[O-])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 C29H28ClFN2O4 MW 523.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28ClFN2O4/c1-28(2)12-21-26(23(34)14-28)25(16-5-10-19(30)20(11-16)33(36)37)27-22(13-29(3,4)15-24(27)35)32(21)18-8-6-17(31)7-9-18/h5-11,25H,12-15H2,1-4H3InChIKey
KNWNPPYBGORKNP-UHFFFAOYSA-NSynonyms
9(4chloro3nitrophenyl)10(4fluorophenyl)3366tetramethyl3467910hexahydroacridine18(2H5H)dione
9(4chloro3nitrophenyl)10(4fluorophenyl)3366tetramethyl4579tetrahydro2Hacridine18dione
CC1(CC2=C(C(C3=C(N2C4=CC=C(C=C4)F)CC(CC3=O)(C)C)C5=CC(=C(C=C5)Cl)(N+)(=O)(O))C(=O)C1)C
Fc1ccc(cc1)N1C2=C(C(=O)CC(C2)(C)C)C(C2=C1CC(C)(C)CC2=O)c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC29H28ClFN2O4c128(2)122126(23(34)1428)25(1651019(30)20(1116)33(36)37)2722(1329(34)1524(27)35)32(21)188617(31)7918h51125H1215H214H3
MFCD14714011
ZINC000020103745
ZINC20103745
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