Vitas-M small molecule compound
(2R,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(3-fluorophenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STK526381
SMILES N#CC1(C#N)[C@@H](c2cccc(c2)F)[C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)C(C)(C)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 C25H22FN3O MW 399.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN3O/c1-24(2,3)23(30)21-20(17-8-6-9-18(26)13-17)25(14-27,15-28)22-19-10-5-4-7-16(19)11-12-29(21)22/h4-13,20-22H,1-3H3/t20-,21+,22-/m0/s1InChIKey
DGLSJBXQRIXFKY-BDTNDASRSA-NSynonyms
305383-18-0(2R3R10bS)2(3fluorophenyl)3pivaloyl23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10bS)3(22dimethylpropanoyl)2(3fluorophenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2R3R10BS)3(22DIMETHYLPROPANOYL)2(3FLUOROPHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
305383180
CC(C)(C)C(=O)C1C(C(C2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=CC(=CC=C4)F
InChI=1SC25H22FN3Oc124(23)23(30)2120(1786918(26)1317)25(14271528)22191054716(19)111229(21)22h4132022H13H3t2021+22m0s1
N#CC1(C#N)(C@@H)(c2cccc(c2)F)(C@@H)(N2(C@H)1c1ccccc1C=C2)C(=O)C(C)(C)C
ZINC000035366037
ZINC35366037
Check stock
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Check stock on Vitas-MAvailable files
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