Vitas-M small molecule compound
10-benzyl-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carbonitrile
Catalog ID
STL349421
SMILES N#CC1N2C=Cc3c(C2C2C1C(=O)N(C2=O)Cc1ccccc1)cccc3
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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 C22H17N3O2 MW 355.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O2/c23-12-17-18-19(20-16-9-5-4-8-15(16)10-11-24(17)20)22(27)25(21(18)26)13-14-6-2-1-3-7-14/h1-11,17-20H,13H2InChIKey
XWNJGDKDMIFFFC-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10benzyl911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carbonitrile
10benzyl911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carbonitrile
C1=CC=C(C=C1)CN2C(=O)C3C(N4C=CC5=CC=CC=C5C4C3C2=O)C#N
InChI=1SC22H17N3O2c2312171819(2016954815(16)101124(17)20)22(27)25(21(18)26)13146213714h1111720H13H2
MFCD07210225
N#C(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)Cc1ccccc1)cccc3
ZINC000020503018
ZINC000245312845
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