Vitas-M small molecule compound
1-[(3-bromo-4-methoxyphenyl)carbonyl]-2-phenyl-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STL238673
SMILES COc1ccc(cc1Br)C(=O)C1N2c3ccccc3C=CC2C(C1c1ccccc1)(C#N)C#N
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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 C28H20BrN3O2 MW 510.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20BrN3O2/c1-34-23-13-11-20(15-21(23)29)27(33)26-25(19-8-3-2-4-9-19)28(16-30,17-31)24-14-12-18-7-5-6-10-22(18)32(24)26/h2-15,24-26H,1H3InChIKey
PQSFKKNPAJDAOW-UHFFFAOYSA-NSynonyms
(1R2R3aS)1(3bromo4methoxybenzoyl)2phenyl12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1((3bromo4methoxyphenyl)carbonyl)2phenyl12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1(3BROMO4METHOXYBENZOYL)2PHENYL23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
COC1=C(C=C(C=C1)C(=O)C2C(C(C3N2C4=CC=CC=C4C=C3)(C#N)C#N)C5=CC=CC=C5)Br
COc1ccc(cc1Br)C(=O)(C@@H)1N2c3ccccc3C=C(C@H)2C((C@H)1c1ccccc1)(C#N)C#N
InChI=1SC28H20BrN3O2c13423131120(1521(23)29)27(33)2625(198324919)28(16301731)241412187561022(18)32(24)26h2152426H1H3
MFCD07199497
ZINC000002351895
ZINC000016037971
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