Vitas-M small molecule compound
6-amino-4-(3-bromophenyl)-3-{[(4-methylphenyl)sulfanyl]methyl}-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK565471
SMILES N#CC1=C(N)Oc2c(C1c1cccc(c1)Br)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 C21H17BrN4OS MW 453.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17BrN4OS/c1-12-5-7-15(8-6-12)28-11-17-19-18(13-3-2-4-14(22)9-13)16(10-23)20(24)27-21(19)26-25-17/h2-9,18H,11,24H2,1H3,(H,25,26)InChIKey
RTTMVNGUVSSQBK-UHFFFAOYSA-NSynonyms
445266-64-8445266648
6amino4(3bromophenyl)3(((4methylphenyl)sulfanyl)methyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3BROMOPHENYL)3((4METHYLPHENYL)SULFANYLMETHYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino4(3bromophenyl)3((ptolylthio)methyl)24dihydropyrano(23c)pyrazole5carbonitrile
CC1=CC=C(C=C1)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=CC=C4)Br
InChI=1SC21H17BrN4OSc1125715(8612)2811171918(1332414(22)913)16(1023)20(24)2721(19)262517h2918H1124H21H3(H2526)
MFCD03798406
N#CC1=C(N)Oc2c(C1c1cccc(c1)Br)c(CSc1ccc(cc1)C)(nH)n2
N#CC1=C(N)Oc2c(C1c1cccc(c1)Br)c(CSc1ccc(cc1)C)n(nH)2
ZINC000008836443
ZINC000008836444
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