Vitas-M small molecule compound

3-chloro-6-methyl-5-oxo-6,11-dihydro-5H-isoindolo[2,1-a]quinazolin-12-ium

Catalog ID
STL329065
SMILES Clc1ccc2c(c1)c(=O)n(c1[n+]2Cc2c1cccc2)C

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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 C16H12ClN2O MW 283.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN2O/c1-18-15-12-5-3-2-4-10(12)9-19(15)14-7-6-11(17)8-13(14)16(18)20/h2-8H,9H2,1H3/q+1
InChIKey
QSDQZBRGKBCLAM-UHFFFAOYSA-N
Synonyms

3CHLORO6METHYL11HISOINDOLO(21A)QUINAZOLIN6IUM5ONE
3chloro6methyl5oxo611dihydro5Hisoindolo(21a)quinazolin12ium
C(N+)1=C2C3=CC=CC=C3CN2C4=C(C1=O)C=C(C=C4)Cl
Clc1ccc2c(c1)c(=O)n(c1(n+)2Cc2c1cccc2)C
InChI=1SC16H12ClN2Oc1181512532410(12)919(15)147611(17)813(14)16(18)20h28H9H21H3q+1
MFCD01084038
ZINC000000507572
ZINC00507572
ZINC507572

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Available files

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