Vitas-M small molecule compound

3-[3-(4-methoxy-1H-indol-1-yl)propyl]-2-methyl-4-oxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3-benzoxazocine-5-carboxamide

Catalog ID
STL551221
SMILES COc1cccc2c1ccn2CCCN1C(=O)C(C(=O)N)C2CC1(C)Oc1c2cccc1

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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 C25H27N3O4 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O4/c1-25-15-18(16-7-3-4-9-21(16)32-25)22(23(26)29)24(30)28(25)13-6-12-27-14-11-17-19(27)8-5-10-20(17)31-2/h3-5,7-11,14,18,22H,6,12-13,15H2,1-2H3,(H2,26,29)
InChIKey
DICZTZWOIHZBKG-UHFFFAOYSA-N
Synonyms
10(3(4methoxyindol1yl)propyl)9methyl11oxo8oxa10azatricyclo(7310^(27))trideca246triene12carboxamide
3(3(4methoxy1Hindol1yl)propyl)2methyl4oxo3456tetrahydro2H26methano13benzoxazocine5carboxamide
3(3(4methoxy1Hindol1yl)propyl)2methyl4oxo3456tetrahydro2H26methanobenzo(g)(13)oxazocine5carboxamide
Registry IDs
MFCD31758013
ZINC000524731598
ZINC000524731599

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Available files

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