Vitas-M small molecule compound
(1Z)-1-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-3-(2,4-dimethoxyphenyl)propan-2-one
Catalog ID
STL514648
SMILES COc1ccc(c(c1)OC)CC(=O)/C=C/1\NCCc2c1cc1OCOc1c2
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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 C21H21NO5 MW 367.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO5/c1-24-16-4-3-14(19(10-16)25-2)7-15(23)9-18-17-11-21-20(26-12-27-21)8-13(17)5-6-22-18/h3-4,8-11,22H,5-7,12H2,1-2H3/b18-9-InChIKey
IRQYHEHKFYPJFS-NVMNQCDNSA-NSynonyms
883953-07-9(1~(Z))1(78dihydro6~(H)(13)dioxolo(45g)isoquinolin5ylidene)3(24dimethoxyphenyl)propan2one
(1Z)1(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)3(24dimethoxyphenyl)propan2one
(Z)1(78DIHYDRO(13)DIOXOLO(45G)ISOQUINOLIN5(6H)YLIDENE)3(24DIMETHOXYPHENYL)PROPAN2ONE
16406227
883953079
COc1ccc(c(c1)OC)CC(=O)C=C1NCCc2c1cc1OCOc1c2
InChI=1SC21H21NO5c124164314(19(1016)252)715(23)91817112120(26122721)813(17)562218h3481122H5712H212H3b189
MFCD07637524
ZINC000004090571
ZINC4090571
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