Vitas-M small molecule compound

2-[(8-bromo-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-6,7-dimethoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline

Catalog ID
STK599960
SMILES COc1cc2CCN(C(c2cc1OC)C)Cc1cc2OCCCOc2cc1Br

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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 C22H26BrNO4 MW 448.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26BrNO4/c1-14-17-11-20(26-3)19(25-2)9-15(17)5-6-24(14)13-16-10-21-22(12-18(16)23)28-8-4-7-27-21/h9-12,14H,4-8,13H2,1-3H3
InChIKey
KVNMEHXAECFYQB-UHFFFAOYSA-N
Synonyms
879567-75-6
2((7bromo34dihydro2H15benzodioxepin8yl)methyl)67dimethoxy1methyl34dihydro1Hisoquinoline
2((8bromo34dihydro2H15benzodioxepin7yl)methyl)67dimethoxy1methyl1234tetrahydroisoquinoline
2((8bromo34dihydro2Hbenzo(b)(14)dioxepin7yl)methyl)67dimethoxy1methyl1234tetrahydroisoquinoline
879567756
CC1C2=CC(=C(C=C2CCN1CC3=CC4=C(C=C3Br)OCCCO4)OC)OC
InChI=1SC22H26BrNO4c114171120(263)19(252)915(17)5624(14)1316102122(1218(16)23)288472721h91214H4813H213H3
MFCD07639905
ZINC000020567694
ZINC000020567695

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Available files

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