Vitas-M small molecule compound

(3,4-dimethoxyphenyl)(3-methyl-1,2,3,6-tetrahydroazepino[4,5-b]indol-5-yl)methanone

Catalog ID
STL521155
SMILES COc1cc(ccc1OC)C(=O)C1=CN(C)CCc2c1[nH]c1c2cccc1

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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 C22H22N2O3 MW 362.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O3/c1-24-11-10-16-15-6-4-5-7-18(15)23-21(16)17(13-24)22(25)14-8-9-19(26-2)20(12-14)27-3/h4-9,12-13,23H,10-11H2,1-3H3
InChIKey
NVJQDWAACMZZLF-UHFFFAOYSA-N
Synonyms
1401583-01-4
(34dimethoxyphenyl)(3methyl1236tetrahydroazepino(45b)indol5yl)methanone
(34dimethoxyphenyl)(3methyl26dihydro1~(H)azepino(45b)indol5yl)methanone
1401583014
71754140
COc1cc(ccc1OC)C(=O)C1=CN(C)CCc2c1(nH)c1c2cccc1
InChI=1SC22H22N2O3c12411101615645718(15)2321(16)17(1324)22(25)148919(262)20(1214)273h49121323H1011H213H3
MFCD22574568
ZINC000079191903
ZINC79191903

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.