Vitas-M small molecule compound

6-amino-4-(2-fluorophenyl)-3-{[(4-methylphenyl)sulfanyl]methyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STL038905
SMILES N#CC1=C(N)Oc2c(C1c1ccccc1F)c(CSc1ccc(cc1)C)n[nH]2

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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 C21H17FN4OS MW 392.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17FN4OS/c1-12-6-8-13(9-7-12)28-11-17-19-18(14-4-2-3-5-16(14)22)15(10-23)20(24)27-21(19)26-25-17/h2-9,18H,11,24H2,1H3,(H,25,26)
InChIKey
OSXXPFCMJMADJG-UHFFFAOYSA-N
Synonyms
371142-86-8
371142868
6amino4(2fluorophenyl)3(((4methylphenyl)sulfanyl)methyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(2FLUOROPHENYL)3((4METHYLPHENYL)SULFANYLMETHYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino4(2fluorophenyl)3((ptolylthio)methyl)24dihydropyrano(23c)pyrazole5carbonitrile
CC1=CC=C(C=C1)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CC=C4F
InChI=1SC21H17FN4OSc1126813(9712)2811171918(14423516(14)22)15(1023)20(24)2721(19)262517h2918H1124H21H3(H2526)
MFCD03801267
N#CC1=C(N)Oc2c(C1c1ccccc1F)c(CSc1ccc(cc1)C)(nH)n2
N#CC1=C(N)Oc2c(C1c1ccccc1F)c(CSc1ccc(cc1)C)n(nH)2
ZINC000006813162
ZINC000006813167

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Available files

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