Vitas-M small molecule compound
6-amino-3-(3-nitrophenyl)-4-(pentafluorophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK763893
SMILES N#CC1=C(N)Oc2c(C1c1c(F)c(F)c(c(c1F)F)F)c(n[nH]2)c1cccc(c1)[N+](=O)[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 C19H8F5N5O3 MW 449.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H8F5N5O3/c20-12-10(13(21)15(23)16(24)14(12)22)9-8(5-25)18(26)32-19-11(9)17(27-28-19)6-2-1-3-7(4-6)29(30)31/h1-4,9H,26H2,(H,27,28)InChIKey
SBIOGPBPLHCMPV-UHFFFAOYSA-NSynonyms
6amino3(3nitrophenyl)4(23456pentafluorophenyl)24dihydropyrano(23c)pyrazole5carbonitrile
6amino3(3nitrophenyl)4(pentafluorophenyl)14dihydropyrano(23c)pyrazole5carbonitrile
C1=CC(=CC(=C1)(N+)(=O)(O))C2=C3C(C(=C(OC3=NN2)N)C#N)C4=C(C(=C(C(=C4F)F)F)F)F
InChI=1SC19H8F5N5O3c201210(13(21)15(23)16(24)14(12)22)98(525)18(26)321911(9)17(272819)62137(46)29(30)31h149H26H2(H2728)
MFCD02324808
N#CC1=C(N)Oc2c(C1c1c(F)c(F)c(c(c1F)F)F)c(n(nH)2)c1cccc(c1)(N+)(=O)(O)
ZINC000008856050
ZINC000008856051
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