Vitas-M small molecule compound

methyl 4-(9-oxo-5,7,9,10-tetrahydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-7-yl)benzoate

Catalog ID
STK805247
SMILES COC(=O)c1ccc(cc1)C1N2C(=O)CSC2=NC2=C1CCc1c2cccc1

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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 C22H18N2O3S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S/c1-27-21(26)15-8-6-14(7-9-15)20-17-11-10-13-4-2-3-5-16(13)19(17)23-22-24(20)18(25)12-28-22/h2-9,20H,10-12H2,1H3
InChIKey
YUCGKCFEEJBBHT-UHFFFAOYSA-N
Synonyms
486440-06-6
486440066
COC(=O)C1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4CC3)N=C5N2C(=O)CS5
InChI=1SC22H18N2O3Sc12721(26)158614(7915)2017111013423516(13)19(17)232224(20)18(25)122822h2920H1012H21H3
methyl4(9oxo57910tetrahydro6Hbenzo(h)(13)thiazolo(23b)quinazolin7yl)benzoate
methyl4(9oxo67910tetrahydro5Hbenzo(h)thiazolo(23b)quinazolin7yl)benzoate
MFCD03195628
ZINC000001165715
ZINC000001165716

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Available files

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