Vitas-M small molecule compound
methyl 1-[(4-chlorophenyl)carbonyl]-3-cyano-2-phenyl-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxylate
Catalog ID
STL233603
SMILES COC(=O)C1(C#N)C(c2ccccc2)C(N2C1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl
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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 C28H21ClN2O3 MW 468.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21ClN2O3/c1-34-27(33)28(17-30)23-16-13-18-7-5-6-10-22(18)31(23)25(24(28)19-8-3-2-4-9-19)26(32)20-11-14-21(29)15-12-20/h2-16,23-25H,1H3InChIKey
USXPEFIPTBHOJD-UHFFFAOYSA-NSynonyms
(1R2R3S)methyl1(4chlorobenzoyl)3cyano2phenyl1233atetrahydropyrrolo(12a)quinoline3carboxylate
COC(=O)(C@@)1(C#N)(C@@H)(c2ccccc2)(C@@H)(N2C1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl
COC(=O)C1(C2C=CC3=CC=CC=C3N2C(C1C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Cl)C#N
InChI=1SC28H21ClN2O3c13427(33)28(1730)231613187561022(18)31(23)25(24(28)198324919)26(32)20111421(29)151220h2162325H1H3
methyl1((4chlorophenyl)carbonyl)3cyano2phenyl1233atetrahydropyrrolo(12a)quinoline3carboxylate
METHYL1(4CHLOROBENZOYL)3CYANO2PHENYL23ADIHYDRO1HPYRROLO(12A)QUINOLINE3CARBOXYLATE
MFCD24858378
ZINC000002348386
ZINC000247857390
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Check stock on Vitas-MAvailable files
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