Vitas-M small molecule compound

2-[(5Z)-5-(6,7-dimethoxy-3,4-dihydroisoquinolin-1(2H)-ylidene)-4-oxopentyl]-1H-isoindole-1,3(2H)-dione

Catalog ID
STK598027
SMILES COc1cc2/C(=C/C(=O)CCCN3C(=O)c4c(C3=O)cccc4)/NCCc2cc1OC

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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 C24H24N2O5 MW 420.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O5/c1-30-21-12-15-9-10-25-20(19(15)14-22(21)31-2)13-16(27)6-5-11-26-23(28)17-7-3-4-8-18(17)24(26)29/h3-4,7-8,12-14,25H,5-6,9-11H2,1-2H3/b20-13-
InChIKey
MODUOIWSCOHYSU-MOSHPQCFSA-N
Synonyms

(Z)2(5(67dimethoxy34dihydroisoquinolin1(2H)ylidene)4oxopentyl)isoindoline13dione
2((5Z)5(67dimethoxy34dihydro2Hisoquinolin1ylidene)4oxopentyl)isoindole13dione
2((5Z)5(67dimethoxy34dihydroisoquinolin1(2H)ylidene)4oxopentyl)1Hisoindole13(2H)dione
COC1=C(C=C2C(=C1)CCNC2=CC(=O)CCCN3C(=O)C4=CC=CC=C4C3=O)OC
COc1cc2C(=CC(=O)CCCN3C(=O)c4c(C3=O)cccc4)NCCc2cc1OC
InChI=1SC24H24N2O5c1302112159102520(19(15)1422(21)312)1316(27)65112623(28)17734818(17)24(26)29h3478121425H56911H212H3b2013
MFCD07639927
ZINC000005428943
ZINC05428943
ZINC5428943

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Available files

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