Vitas-M small molecule compound
3-[({2-[4-(acetyloxy)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl}carbonyl)amino]-4-methylbenzoic acid
Catalog ID
STK070757
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1cc(ccc1C)C(=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 C25H18N2O7 MW 458.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N2O7/c1-13-3-4-16(25(32)33)12-21(13)26-22(29)15-5-10-19-20(11-15)24(31)27(23(19)30)17-6-8-18(9-7-17)34-14(2)28/h3-12H,1-2H3,(H,26,29)(H,32,33)InChIKey
KAUHDMQFNIIVGH-UHFFFAOYSA-NSynonyms
3(((2(4(ACETYLOXY)PHENYL)13DIOXO23DIHYDRO1HISOINDOL5YL)CARBONYL)AMINO)4METHYLBENZOICACID
3((2(4ACETYLOXYPHENYL)13DIOXOISOINDOLE5CARBONYL)AMINO)4METHYLBENZOICACID
CC(=O)Oc1ccc(cc1)N1C(=O)c2c(C1=O)ccc(c2)C(=O)Nc1cc(ccc1C)C(=O)O
CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=C(C=C4)OC(=O)C
InChI=1SC25H18N2O7c1133416(25(32)33)1221(13)2622(29)155101920(1115)24(31)27(23(19)30)176818(9717)3414(2)28h312H12H3(H2629)(H3233)
MFCD01158935
STK070757
ZINC000009635663
ZINC9635663
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