Vitas-M small molecule compound

6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STK677401
SMILES CCOc1cc(cc(c1O)[N+](=O)[O-])C1C(=C(N)Oc2c1c(n[nH]2)c1ccncc1)C#N

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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 C20H16N6O5 MW 420.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6O5/c1-2-30-14-8-11(7-13(18(14)27)26(28)29)15-12(9-21)19(22)31-20-16(15)17(24-25-20)10-3-5-23-6-4-10/h3-8,15,27H,2,22H2,1H3,(H,24,25)
InChIKey
CKSPWZPAXMIEMS-UHFFFAOYSA-N
Synonyms

6amino4(3ethoxy4hydroxy5nitrophenyl)3(pyridin4yl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3ETHOXY4HYDROXY5NITROPHENYL)3PYRIDIN4YL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(3ETHOXY4HYDROXY5NITROPHENYL)3PYRIDIN4YL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(5ETHOXY4HYDROXY3NITROPHENYL)3(4PYRIDYL)4HPYRANO(32D)PYRAZOLE5CARBONITRILE
CCOC1=CC(=CC(=C1O)(N+)(=O)(O))C2C(=C(OC3=NNC(=C23)C4=CC=NC=C4)N)C#N
CCOc1cc(cc(c1O)(N+)(=O)(O))C1C(=C(N)Oc2c1c(n(nH)2)c1ccncc1)C#N
InChI=1SC20H16N6O5c123014811(713(18(14)27)26(28)29)1512(921)19(22)312016(15)17(242520)1035236410h381527H222H21H3(H2425)
MFCD03035404
ZINC000035104191
ZINC000035104192

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Available files

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