Vitas-M small molecule compound

8-(4-bromophenyl)-9-(phenylcarbonyl)-8,9-dihydropyrrolo[1,2-a][1,5]naphthyridine-7,7(6aH)-dicarbonitrile

Catalog ID
STL325939
SMILES N#CC1(C#N)C(c2ccc(cc2)Br)C(N2C1C=Cc1c2cccn1)C(=O)c1ccccc1

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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 C26H17BrN4O MW 481.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H17BrN4O/c27-19-10-8-17(9-11-19)23-24(25(32)18-5-2-1-3-6-18)31-21-7-4-14-30-20(21)12-13-22(31)26(23,15-28)16-29/h1-14,22-24H
InChIKey
WXSOATGWPQEUGZ-UHFFFAOYSA-N
Synonyms

(6aR8S9S)9benzoyl8(4bromophenyl)89dihydropyrrolo(12a)(15)naphthyridine77(6aH)dicarbonitrile
8(4bromophenyl)9(phenylcarbonyl)89dihydropyrrolo(12a)(15)naphthyridine77(6aH)dicarbonitrile
9BENZOYL8(4BROMOPHENYL)89DIHYDRO6AHPYRROLO(12A)(15)NAPHTHYRIDINE77DICARBONITRILE
C1=CC=C(C=C1)C(=O)C2C(C(C3N2C4=C(C=C3)N=CC=C4)(C#N)C#N)C5=CC=C(C=C5)Br
InChI=1SC26H17BrN4Oc271910817(91119)2324(25(32)185213618)312174143020(21)121322(31)26(231528)1629h1142224H
MFCD28030849
N#CC1(C#N)(C@H)(c2ccc(cc2)Br)(C@H)(N2(C@@H)1C=Cc1c2cccn1)C(=O)c1ccccc1
ZINC000009144805
ZINC000035211511

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Available files

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