Vitas-M small molecule compound
3-cyano-2-(2-ethoxyphenyl)-1-(phenylcarbonyl)-1,2,3,3a-tetrahydropyrrolo[1,2-a]quinoline-3-carboxamide
Catalog ID
STL342821
SMILES CCOc1ccccc1C1C(C(=O)c2ccccc2)N2C(C1(C#N)C(=O)N)C=Cc1c2cccc1
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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 C29H25N3O3 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O3/c1-2-35-23-15-9-7-13-21(23)25-26(27(33)20-11-4-3-5-12-20)32-22-14-8-6-10-19(22)16-17-24(32)29(25,18-30)28(31)34/h3-17,24-26H,2H2,1H3,(H2,31,34)InChIKey
JDNFOGDUUBKQNK-UHFFFAOYSA-NSynonyms
(1S2S3S)1benzoyl3cyano2(2ethoxyphenyl)1233atetrahydropyrrolo(12a)quinoline3carboxamide
1BENZOYL3CYANO2(2ETHOXYPHENYL)23ADIHYDRO1HPYRROLO(12A)QUINOLINE3CARBOXAMIDE
3cyano2(2ethoxyphenyl)1(phenylcarbonyl)1233atetrahydropyrrolo(12a)quinoline3carboxamide
CCOC1=CC=CC=C1C2C(N3C(C2(C#N)C(=O)N)C=CC4=CC=CC=C43)C(=O)C5=CC=CC=C5
CCOc1ccccc1(C@@H)1(C@@H)(C(=O)c2ccccc2)N2C((C@@)1(C#N)C(=O)N)C=Cc1c2cccc1
InChI=1SC29H25N3O3c12352315971321(23)2526(27(33)20114351220)322214861019(22)161724(32)29(251830)28(31)34h3172426H2H21H3(H23134)
MFCD28032483
ZINC000015989237
ZINC000245310417
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