Vitas-M small molecule compound

2-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}-5,6,7,8-tetrahydroquinoline-3-carbonitrile

Catalog ID
STK085816
SMILES N#Cc1cc2CCCCc2nc1SCC(=O)c1cc2ccccc2oc1=O

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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 C21H16N2O3S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S/c22-11-15-9-13-5-1-3-7-17(13)23-20(15)27-12-18(24)16-10-14-6-2-4-8-19(14)26-21(16)25/h2,4,6,8-10H,1,3,5,7,12H2
InChIKey
LYXJJAFLJYKUBN-UHFFFAOYSA-N
Synonyms
370871-17-3
2((2oxo2(2oxo2Hchromen3yl)ethyl)sulfanyl)5678tetrahydroquinoline3carbonitrile
2((2oxo2(2oxo2Hchromen3yl)ethyl)thio)5678tetrahydroquinoline3carbonitrile
2(2oxo2(2oxochromen3yl)ethyl)sulfanyl5678tetrahydroquinoline3carbonitrile
370871173
C1CCC2=C(C1)C=C(C(=N2)SCC(=O)C3=CC4=CC=CC=C4OC3=O)C#N
InChI=1SC21H16N2O3Sc221115913513717(13)2320(15)271218(24)161014624819(14)2621(16)25h246810H135712H2
MFCD03010669
N#Cc1cc2CCCCc2nc1SCC(=O)c1cc2ccccc2oc1=O
STK085816
ZINC000001243650
ZINC01243650
ZINC1243650

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Available files

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