Vitas-M small molecule compound

2-chloro-1-[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]ethanone

Catalog ID
STK993524
SMILES CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)CCl

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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 C26H34ClNO5 MW 476.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34ClNO5/c1-5-30-22-10-9-18(14-23(22)31-6-2)13-21-20-16-25(33-8-4)24(32-7-3)15-19(20)11-12-28(21)26(29)17-27/h9-10,14-16,21H,5-8,11-13,17H2,1-4H3
InChIKey
DMIXIQXPSOLPHG-UHFFFAOYSA-N
Synonyms
730949-62-9
2CHLORO1(1((34DIETHOXYPHENYL)METHYL)67DIETHOXY34DIHYDRO1HISOQUINOLIN2YL)ETHANONE
2CHLORO1(1(34DIETHOXYBENZYL)67DIETHOXY34DIHYDRO1HISOQUINOLIN2YL)ETHANONE
2chloro1(1(34diethoxybenzyl)67diethoxy34dihydroisoquinolin2(1H)yl)ethanone
730949629
CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)CCl)OCC)OCC)OCC
InChI=1SC26H34ClNO5c15302210918(1423(22)3162)1321201625(3384)24(3273)1519(20)111228(21)26(29)1727h910141621H58111317H214H3
MFCD04621450
ZINC000003277956
ZINC000003277958

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Available files

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