Vitas-M small molecule compound
2-(3,4-dimethoxyphenyl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STL320688
SMILES N#CC1(C#N)C(c2ccc(c(c2)OC)OC)C(N2C1c1ccccc1C=C2)C(=O)C12CC3CC(C2)CC(C1)C3
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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 C33H33N3O3 MW 519.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33N3O3/c1-38-26-8-7-24(14-27(26)39-2)28-29(31(37)32-15-20-11-21(16-32)13-22(12-20)17-32)36-10-9-23-5-3-4-6-25(23)30(36)33(28,18-34)19-35/h3-10,14,20-22,28-30H,11-13,15-17H2,1-2H3InChIKey
GMRFUVVWFGGPMV-UHFFFAOYSA-NSynonyms
(2R3R10bS)3((3R5R7R)adamantane1carbonyl)2(34dimethoxyphenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
2(34dimethoxyphenyl)3(tricyclo(3311~37~)dec1ylcarbonyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
3(ADAMANTANE1CARBONYL)2(34DIMETHOXYPHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
COC1=C(C=C(C=C1)C2C(N3C=CC4=CC=CC=C4C3C2(C#N)C#N)C(=O)C56CC7CC(C5)CC(C7)C6)OC
InChI=1SC33H33N3O3c138268724(1427(26)392)2829(31(37)3215201121(1632)1322(1220)1732)3610923534625(23)30(36)33(281834)1935h3101420222830H11131517H212H3
N#CC1(C#N)(C@@H)(c2ccc(c(c2)OC)OC)(C@@H)(N2(C@H)1c1ccccc1C=C2)C(=O)C12CC3CC(C2)CC(C1)C3
ZINC000016037268
ZINC000245309971
Check stock
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Check stock on Vitas-MAvailable files
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