Vitas-M small molecule compound

1-(4-chlorophenyl)-3-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl)-1H-pyrrole-2,5-dione

Catalog ID
STK212804
SMILES Clc1ccc(cc1)N1C(=O)C=C(C1=O)N1CC2CC(C1)c1n(C2)c(=O)ccc1

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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 C21H18ClN3O3 MW 395.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3/c22-15-4-6-16(7-5-15)25-20(27)9-18(21(25)28)23-10-13-8-14(12-23)17-2-1-3-19(26)24(17)11-13/h1-7,9,13-14H,8,10-12H2
InChIKey
GDVPAVJJASJGPM-UHFFFAOYSA-N
Synonyms

1(4chlorophenyl)3(8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)1Hpyrrole25dione
C1C2CN(CC1C3=CC=CC(=O)N3C2)C4=CC(=O)N(C4=O)C5=CC=C(C=C5)Cl
InChI=1SC21H18ClN3O3c22154616(7515)2520(27)918(21(25)28)231013814(1223)1721319(26)24(17)1113h1791314H81012H2
MFCD07657438
ZINC000004772627

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Available files

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