Vitas-M small molecule compound

9-(4-chloro-3-nitrophenyl)-10-(3,4-dimethylphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione

Catalog ID
STK914495
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(c(c1)[N+](=O)[O-])Cl)C1=C(N2c2ccc(c(c2)C)C)CC(CC1=O)(C)C

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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 C31H33ClN2O4 MW 533.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33ClN2O4/c1-17-7-9-20(11-18(17)2)33-23-13-30(3,4)15-25(35)28(23)27(19-8-10-21(32)22(12-19)34(37)38)29-24(33)14-31(5,6)16-26(29)36/h7-12,27H,13-16H2,1-6H3
InChIKey
YZSVTMITSOIMAA-UHFFFAOYSA-N
Synonyms

9(4chloro3nitrophenyl)10(34dimethylphenyl)3366tetramethyl3467910hexahydroacridine18(2H5H)dione
9(4chloro3nitrophenyl)10(34dimethylphenyl)3366tetramethyl4579tetrahydro2Hacridine18dione
CC1=C(C=C(C=C1)N2C3=C(C(C4=C2CC(CC4=O)(C)C)C5=CC(=C(C=C5)Cl)(N+)(=O)(O))C(=O)CC(C3)(C)C)C
InChI=1SC31H33ClN2O4c1177920(1118(17)2)33231330(34)1525(35)28(23)27(1981021(32)22(1219)34(37)38)2924(33)1431(56)1626(29)36h71227H1316H216H3
MFCD14714003
O=C1CC(C)(C)CC2=C1C(c1ccc(c(c1)(N+)(=O)(O))Cl)C1=C(N2c2ccc(c(c2)C)C)CC(CC1=O)(C)C
ZINC000020103743
ZINC20103743

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Available files

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