Vitas-M small molecule compound

2-{[(6,7-dihydroxy-2-oxo-2H-chromen-4-yl)methyl]sulfanyl}-4,6-dimethylpyridine-3-carbonitrile

Catalog ID
STK925725
SMILES N#Cc1c(C)cc(nc1SCc1cc(=O)oc2c1cc(O)c(c2)O)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 C18H14N2O4S MW 354.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O4S/c1-9-3-10(2)20-18(13(9)7-19)25-8-11-4-17(23)24-16-6-15(22)14(21)5-12(11)16/h3-6,21-22H,8H2,1-2H3
InChIKey
NLQYKBAOOVZMDR-UHFFFAOYSA-N
Synonyms
1007683-80-8
1007683808
2(((67dihydroxy2oxo2Hchromen4yl)methyl)sulfanyl)46dimethylpyridine3carbonitrile
2(((67DIHYDROXY2OXO2HCHROMEN4YL)METHYL)THIO)46DIMETHYLNICOTINONITRILE
2((67dihydroxy2oxochromen4yl)methylsulfanyl)46dimethylpyridine3carbonitrile
2((67DIHYDROXY2OXOCHROMEN4YL)METHYLTHIO)46DIMETHYLPYRIDINE3CARBONITRILE
CC1=CC(=NC(=C1C#N)SCC2=CC(=O)OC3=CC(=C(C=C23)O)O)C
InChI=1SC18H14N2O4Sc19310(2)2018(13(9)719)25811417(23)2416615(22)14(21)512(11)16h362122H8H212H3
MFCD10041377
ZINC000011865324
ZINC11865324

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Available files

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