Vitas-M small molecule compound
ethyl 1-[(3-bromo-4-methoxyphenyl)carbonyl]-3-cyano-2-(3,4-dimethoxyphenyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Catalog ID
STL408561
SMILES CCOC(=O)C1(C#N)C(c2ccc(c(c2)OC)OC)C(N2C1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC
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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 C32H29BrN2O6 MW 617.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29BrN2O6/c1-5-41-31(37)32(18-34)27-15-12-19-8-6-7-9-23(19)35(27)29(30(36)21-11-13-24(38-2)22(33)16-21)28(32)20-10-14-25(39-3)26(17-20)40-4/h6-17,27-29H,5H2,1-4H3InChIKey
FPXSAVMIPWIPHN-UHFFFAOYSA-NSynonyms
(1R2R3S3aS)ethyl1(3bromo4methoxybenzoyl)3cyano2(34dimethoxyphenyl)1233atetrahydropyrrolo(12a)quinoline3carboxylate
CCOC(=O)(C@@)1(C#N)(C@@H)(c2ccc(c(c2)OC)OC)(C@@H)(N2(C@H)1C=Cc1c2cccc1)C(=O)c1ccc(c(c1)Br)OC
CCOC(=O)C1(C2C=CC3=CC=CC=C3N2C(C1C4=CC(=C(C=C4)OC)OC)C(=O)C5=CC(=C(C=C5)OC)Br)C#N
ethyl1((3bromo4methoxyphenyl)carbonyl)3cyano2(34dimethoxyphenyl)1233atetrahydropyrrolo(12a)quinoline3carboxylate
ETHYL1(3BROMO4METHOXYBENZOYL)3CYANO2(34DIMETHOXYPHENYL)23ADIHYDRO1HPYRROLO(12A)QUINOLINE3CARBOXYLATE
InChI=1SC32H29BrN2O6c154131(37)32(1834)27151219867923(19)35(27)29(30(36)21111324(382)22(33)1621)28(32)20101425(393)26(1720)404h6172729H5H214H3
MFCD04071690
ZINC000225217015
ZINC000253389786
Check stock
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Check stock on Vitas-MAvailable files
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