Vitas-M small molecule compound

3-[(4-methylbenzyl)sulfanyl]quinoxalin-2(1H)-one

Catalog ID
STK737253
SMILES Cc1ccc(cc1)CSc1nc2ccccc2[nH]c1=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 C16H14N2OS MW 282.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2OS/c1-11-6-8-12(9-7-11)10-20-16-15(19)17-13-4-2-3-5-14(13)18-16/h2-9H,10H2,1H3,(H,17,19)
InChIKey
YVVLUYPNJPLMHB-UHFFFAOYSA-N
Synonyms

2(1H)QUINOXALINONE3(((4METHYLPHENYL)METHYL)THIO)
3((4methylbenzyl)sulfanyl)quinoxalin2(1H)one
3((4METHYLPHENYL)METHYLSULFANYL)1HQUINOXALIN2ONE
3((4METHYLPHENYL)METHYLTHIO)HYDROQUINOXALIN2ONE
CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3NC2=O
Cc1ccc(cc1)CSc1nc2ccccc2(nH)c1=O
InChI=1SC16H14N2OSc1116812(9711)10201615(19)1713423514(13)1816h29H10H21H3(H1719)
MFCD06016523
ZINC000004625536
ZINC04625536
ZINC4625536

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Available files

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