Vitas-M small molecule compound
(4-bromophenyl)[1-(3,4-diethoxybenzyl)-6,7-diethoxy-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Catalog ID
STK629498
SMILES CCOc1cc(ccc1OCC)CC1N(CCc2c1cc(OCC)c(c2)OCC)C(=O)c1ccc(cc1)Br
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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 C31H36BrNO5 MW 582.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36BrNO5/c1-5-35-27-14-9-21(18-28(27)36-6-2)17-26-25-20-30(38-8-4)29(37-7-3)19-23(25)15-16-33(26)31(34)22-10-12-24(32)13-11-22/h9-14,18-20,26H,5-8,15-17H2,1-4H3InChIKey
WSXRBSABPKWVRO-UHFFFAOYSA-NSynonyms
673440-79-4(4BROMOPHENYL)(1((34DIETHOXYPHENYL)METHYL)67DIETHOXY34DIHYDRO1HISOQUINOLIN2YL)METHANONE
(4bromophenyl)(1(34diethoxybenzyl)67diethoxy34dihydroisoquinolin2(1H)yl)methanone
673440794
CCOC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C(=O)C4=CC=C(C=C4)Br)OCC)OCC)OCC
InChI=1SC31H36BrNO5c15352714921(1828(27)3662)1726252030(3884)29(3773)1923(25)151633(26)31(34)22101224(32)131122h914182026H581517H214H3
MFCD03661130
ZINC000001835261
ZINC000001835262
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