Vitas-M small molecule compound

1-acetyl-2-(3-chlorophenyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile

Catalog ID
STL335524
SMILES N#CC1(C#N)C(c2cccc(c2)Cl)C(N2C1C=Cc1c2cccc1)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 C22H16ClN3O MW 373.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O/c1-14(27)21-20(16-6-4-7-17(23)11-16)22(12-24,13-25)19-10-9-15-5-2-3-8-18(15)26(19)21/h2-11,19-21H,1H3
InChIKey
QEPNCFQURFZJLJ-UHFFFAOYSA-N
Synonyms

(1R2R3AR)1ACETYL2(3CHLOROPHENYL)12DIHYDROPYRROLO(12A)QUINOLINE33(3AH)DICARBONITRILE
(1S2S3aR)1acetyl2(3chlorophenyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1acetyl2(3chlorophenyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1ACETYL2(3CHLOROPHENYL)23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
CC(=O)C1C(C(C2N1C3=CC=CC=C3C=C2)(C#N)C#N)C4=CC(=CC=C4)Cl
InChI=1SC22H16ClN3Oc114(27)2120(1664717(23)1116)22(12241325)1910915523818(15)26(19)21h2111921H1H3
MFCD28032043
N#CC1(C#N)(C@H)(c2cccc(c2)Cl)(C@H)(N2(C@@H)1C=Cc1c2cccc1)C(=O)C
ZINC000004457550
ZINC000036006919

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Available files

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