Vitas-M small molecule compound
3-cyano-2-(3,4-dimethoxyphenyl)-7-fluoro-1-(phenylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Catalog ID
STK784862
SMILES COc1ccc(cc1OC)C1C(C(=O)c2ccccc2)N2C(C1(C#N)C(=O)N)C=Cc1c2ccc(c1)F
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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 C29H24FN3O4 MW 497.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24FN3O4/c1-36-22-12-8-19(15-23(22)37-2)25-26(27(34)17-6-4-3-5-7-17)33-21-11-10-20(30)14-18(21)9-13-24(33)29(25,16-31)28(32)35/h3-15,24-26H,1-2H3,(H2,32,35)InChIKey
LTRMVIJAKVNGSJ-UHFFFAOYSA-NSynonyms
1BENZOYL3CYANO2(34DIMETHOXYPHENYL)7FLUORO23ADIHYDRO1HPYRROLO(12A)QUINOLINE3CARBOXAMIDE
3cyano2(34dimethoxyphenyl)7fluoro1(phenylcarbonyl)1233atetrahydropyrrolo(12a)quinoline3carboxamide
COC1=C(C=C(C=C1)C2C(N3C(C2(C#N)C(=O)N)C=CC4=C3C=CC(=C4)F)C(=O)C5=CC=CC=C5)OC
InChI=1SC29H24FN3O4c1362212819(1523(22)372)2526(27(34)176435717)3321111020(30)1418(21)91324(33)29(251631)28(32)35h3152426H12H3(H23235)
MFCD07657219
ZINC000012371257
ZINC000248133293
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