Vitas-M small molecule compound

(2R,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(naphthalen-1-yl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile

Catalog ID
STK754990
SMILES N#CC1(C#N)[C@H]2N([C@H]([C@@H]1c1cccc3c1cccc3)C(=O)C(C)(C)C)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 C29H25N3O MW 431.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O/c1-28(2,3)27(33)25-24(23-14-8-11-19-9-4-6-12-21(19)23)29(17-30,18-31)26-22-13-7-5-10-20(22)15-16-32(25)26/h4-16,24-26H,1-3H3/t24-,25+,26-/m0/s1
InChIKey
SDLIEYULIJAVBE-NXCFDTQHSA-N
Synonyms
295779-57-6
(2R3R10bS)2(naphthalen1yl)3pivaloyl23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10bS)3(22dimethylpropanoyl)2(naphthalen1yl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10BS)3(22DIMETHYLPROPANOYL)2NAPHTHALEN1YL310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
295779576
CC(C)(C)C(=O)C1C(C(C2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=CC=CC5=CC=CC=C54
InChI=1SC29H25N3Oc128(23)27(33)2524(2314811199461221(19)23)29(17301831)262213751020(22)151632(25)26h4162426H13H3t2425+26m0s1
MFCD01244565
N#CC1(C#N)(C@H)2N((C@H)((C@@H)1c1cccc3c1cccc3)C(=O)C(C)(C)C)C=Cc1c2cccc1
ZINC000035366029
ZINC35366029

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Available files

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