Vitas-M small molecule compound

3-[(4-methylphenyl)sulfanyl]-2H-chromen-2-one

Catalog ID
STK124243
SMILES Cc1ccc(cc1)Sc1cc2ccccc2oc1=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 C16H12O2S MW 268.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12O2S/c1-11-6-8-13(9-7-11)19-15-10-12-4-2-3-5-14(12)18-16(15)17/h2-10H,1H3
InChIKey
QGARYFWQRLPMFM-UHFFFAOYSA-N
Synonyms
78440-59-2
3((4METHYLPHENYL)SULFANYL)2HCHROMEN2ONE
3(4METHYLPHENYL)SULFANYLCHROMEN2ONE
3(4METHYLPHENYLTHIO)CHROMEN2ONE
3(PTOLYLTHIO)2H1BENZOPYRAN2ONE
78440592
CC1=CC=C(C=C1)SC2=CC3=CC=CC=C3OC2=O
InChI=1SC16H12O2Sc1116813(9711)19151012423514(12)1816(15)17h210H1H3
MFCD01105889
ZINC000000342294
ZINC00342294
ZINC342294

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Available files

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