Vitas-M small molecule compound
10-(4-methoxyphenyl)-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
STL346025
SMILES COc1ccc(cc1)N1C(=O)C2C(C1=O)C(N1C2c2ccccc2C=C1)C#N
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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 C22H17N3O3 MW 371.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O3/c1-28-15-8-6-14(7-9-15)25-21(26)18-17(12-23)24-11-10-13-4-2-3-5-16(13)20(24)19(18)22(25)27/h2-11,17-20H,1H3InChIKey
RKIJASNCZKCRBN-UHFFFAOYSA-NSynonyms
(8S8aR11aS)10(4methoxyphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carbonitrile
10(4methoxyphenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carbonitrile
COC1=CC=C(C=C1)N2C(=O)C3C(N4C=CC5=CC=CC=C5C4C3C2=O)C#N
COc1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)(C@H)(N1C2c2ccccc2C=C1)C#N
InChI=1SC22H17N3O3c128158614(7915)2521(26)1817(1223)24111013423516(13)20(24)19(18)22(25)27h2111720H1H3
MFCD28032191
ZINC000015999089
ZINC000245311988
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