Vitas-M small molecule compound

6,7-diethoxy-1-(4-methoxyphenyl)-2-(4-methylphenyl)-1,4-dihydroisoquinolin-3(2H)-one

Catalog ID
STL015367
SMILES CCOc1cc2c(cc1OCC)CC(=O)N(C2c1ccc(cc1)OC)c1ccc(cc1)C

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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 C27H29NO4 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO4/c1-5-31-24-15-20-16-26(29)28(21-11-7-18(3)8-12-21)27(23(20)17-25(24)32-6-2)19-9-13-22(30-4)14-10-19/h7-15,17,27H,5-6,16H2,1-4H3
InChIKey
AKTSCGDUUPTRRN-UHFFFAOYSA-N
Synonyms
639005-43-9
639005439
67diethoxy1(4methoxyphenyl)2(4methylphenyl)14dihydroisoquinolin3(2H)one
67DIETHOXY1(4METHOXYPHENYL)2(4METHYLPHENYL)14DIHYDROISOQUINOLIN3ONE
67diethoxy1(4methoxyphenyl)2(ptolyl)12dihydroisoquinolin3(4H)one
CCOC1=C(C=C2C(N(C(=O)CC2=C1)C3=CC=C(C=C3)C)C4=CC=C(C=C4)OC)OCC
InChI=1SC27H29NO4c15312415201626(29)28(2111718(3)81221)27(23(20)1725(24)3262)1991322(304)141019h7151727H5616H214H3
MFCD03869791
ZINC000002402130
ZINC000002402131

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Available files

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