Vitas-M small molecule compound

(2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-1-(2,3-dimethyl-1H-indol-5-yl)ethanone

Catalog ID
STL058076
SMILES O=C(c1ccc2c(c1)c(C)c([nH]2)C)/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 C22H20N2O3 MW 360.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O3/c1-12-13(2)24-18-4-3-15(7-16(12)18)20(25)10-19-17-9-22-21(26-11-27-22)8-14(17)5-6-23-19/h3-4,7-10,23-24H,5-6,11H2,1-2H3/b19-10-
InChIKey
UTLLSPIFNAPIDU-GRSHGNNSSA-N
Synonyms

(2Z)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)1(23dimethyl1Hindol5yl)ethanone
(2Z)2(78dihydro6H(13)dioxolo(45g)isoquinolin5ylidene)1(23dimethyl1Hindol5yl)ethanone
(Z)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)1(23dimethyl1Hindol5yl)ethanone
CC1=C(NC2=C1C=C(C=C2)C(=O)C=C3C4=CC5=C(C=C4CCN3)OCO5)C
InChI=1SC22H20N2O3c11213(2)24184315(716(12)18)20(25)10191792221(26112722)814(17)562319h347102324H5611H212H3b1910
MFCD07638969
O=C(c1ccc2c(c1)c(C)c((nH)2)C)C=C1NCCc2c1cc1OCOc1c2
ZINC000005423565
ZINC05423565
ZINC5423565

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Available files

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