Vitas-M small molecule compound

6-fluoro-2-methyl-N-(4-methyl-2-oxo-2H-chromen-7-yl)-3,4-dihydroquinoline-1(2H)-carbothioamide

Catalog ID
STK445795
SMILES Fc1ccc2c(c1)CCC(N2C(=S)Nc1ccc2c(c1)oc(=O)cc2C)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 C21H19FN2O2S MW 382.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN2O2S/c1-12-9-20(25)26-19-11-16(6-7-17(12)19)23-21(27)24-13(2)3-4-14-10-15(22)5-8-18(14)24/h5-11,13H,3-4H2,1-2H3,(H,23,27)
InChIKey
CUJBDAGZRSRBFP-UHFFFAOYSA-N
Synonyms

6fluoro2methylN(4methyl2oxo2Hchromen7yl)34dihydroquinoline1(2H)carbothioamide
6fluoro2methylN(4methyl2oxochromen7yl)34dihydro2Hquinoline1carbothioamide
CC1CCC2=C(N1C(=S)NC3=CC4=C(C=C3)C(=CC(=O)O4)C)C=CC(=C2)F
InChI=1SC21H19FN2O2Sc112920(25)26191116(6717(12)19)2321(27)2413(2)34141015(22)5818(14)24h51113H34H212H3(H2327)
MFCD04058301
ZINC000006399716
ZINC000006399724

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Available files

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