Vitas-M small molecule compound
6-amino-4-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK013980
SMILES CCOc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])C1C(=C(N)Oc2c1c(C)n[nH]2)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 C22H18N6O7 MW 478.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N6O7/c1-3-33-18-8-12(20-14(10-23)21(24)35-22-19(20)11(2)25-26-22)4-6-17(18)34-16-7-5-13(27(29)30)9-15(16)28(31)32/h4-9,20H,3,24H2,1-2H3,(H,25,26)InChIKey
UUUGKDLVYBHCQS-UHFFFAOYSA-NSynonyms
6AMINO4(4(24DINITROPHENOXY)3ETHOXYPHENYL)3METHYL14DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6AMINO4(4(24DINITROPHENOXY)3ETHOXYPHENYL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CCOC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)C)N)C#N)OC4=C(C=C(C=C4)(N+)(=O)(O))(N+)(=O)(O)
CCOc1cc(ccc1Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))C1C(=C(N)Oc2c1c(C)n(nH)2)C#N
InChI=1SC22H18N6O7c133318812(2014(1023)21(24)352219(20)11(2)252622)4617(18)34167513(27(29)30)915(16)28(31)32h4920H324H212H3(H2526)
MFCD02631346
STK013980
ZINC000008983986
ZINC000008983990
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Check stock on Vitas-MAvailable files
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