Vitas-M small molecule compound
3-acetyl-2-(2,3-difluorophenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STL326815
SMILES N#CC1(C#N)C2c3ccccc3C=CN2C(C1c1cccc(c1F)F)C(=O)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 C22H15F2N3O MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15F2N3O/c1-13(28)20-18(16-7-4-8-17(23)19(16)24)22(11-25,12-26)21-15-6-3-2-5-14(15)9-10-27(20)21/h2-10,18,20-21H,1H3InChIKey
LKNUEHIZNUCUFJ-UHFFFAOYSA-NSynonyms
(2S3R10bS)3acetyl2(23difluorophenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
3acetyl2(23difluorophenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
3ACETYL2(23DIFLUOROPHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
CC(=O)C1C(C(C2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=C(C(=CC=C4)F)F
InChI=1SC22H15F2N3Oc113(28)2018(1674817(23)19(16)24)22(11251226)2115632514(15)91027(20)21h210182021H1H3
MFCD28030862
N#CC1(C#N)(C@@H)2c3ccccc3C=CN2(C@H)((C@@H)1c1cccc(c1F)F)C(=O)C
ZINC000002275071
ZINC000108520074
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