Vitas-M small molecule compound
2'-(1,3-benzodioxol-5-ylcarbonyl)-1'-[(4-methoxyphenyl)carbonyl]-5'-methyl-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STL528725
SMILES COc1ccc(cc1)C(=O)C1N2c3ccccc3C(=CC2C2(C1C(=O)c1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1)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 C36H28N2O6 MW 584.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H28N2O6/c1-20-17-30-36(25-8-4-5-9-26(25)37-35(36)41)31(33(39)22-13-16-28-29(18-22)44-19-43-28)32(38(30)27-10-6-3-7-24(20)27)34(40)21-11-14-23(42-2)15-12-21/h3-18,30-32H,19H2,1-2H3,(H,37,41)InChIKey
NZGBXMWGTAGNDK-UHFFFAOYSA-NSynonyms
(1S2S3R3aR)2(benzo(d)(13)dioxole5carbonyl)1(4methoxybenzoyl)5methyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
2(13benzodioxol5ylcarbonyl)1((4methoxyphenyl)carbonyl)5methyl12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
2(13benzodioxole5carbonyl)1(4methoxybenzoyl)5methylspiro(1~(H)indole3323~(a)dihydro1~(H)pyrrolo(12a)quinoline)2one
5235242
COc1ccc(cc1)C(=O)(C@H)1N2c3ccccc3C(=C(C@@H)2(C@)2((C@@H)1C(=O)c1ccc3c(c1)OCO3)C(=O)Nc1c2cccc1)C
InChI=1SC36H28N2O6c120173036(25845926(25)3735(36)41)31(33(39)2213162829(1822)44194328)32(38(30)271063724(20)27)34(40)21111423(422)151221h3183032H19H212H3(H3741)
MFCD05738645
ZINC000229599829
ZINC000248336127
Check stock
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Check stock on Vitas-MAvailable files
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