Vitas-M small molecule compound
6-amino-4-(3-ethoxy-4-methoxyphenyl)-3-(3-nitrophenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK996313
SMILES CCOc1cc(ccc1OC)C1C(=C(N)Oc2c1c(n[nH]2)c1cccc(c1)[N+](=O)[O-])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 C22H19N5O5 MW 433.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O5/c1-3-31-17-10-12(7-8-16(17)30-2)18-15(11-23)21(24)32-22-19(18)20(25-26-22)13-5-4-6-14(9-13)27(28)29/h4-10,18H,3,24H2,1-2H3,(H,25,26)InChIKey
IHKSXNPCNOLBHL-UHFFFAOYSA-NSynonyms
6amino4(3ethoxy4methoxyphenyl)3(3nitrophenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(3ETHOXY4METHOXYPHENYL)3(3NITROPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CCOC1=C(C=CC(=C1)C2C(=C(OC3=NNC(=C23)C4=CC(=CC=C4)(N+)(=O)(O))N)C#N)OC
CCOc1cc(ccc1OC)C1C(=C(N)Oc2c1c(n(nH)2)c1cccc(c1)(N+)(=O)(O))C#N
InChI=1SC22H19N5O5c1331171012(7816(17)302)1815(1123)21(24)322219(18)20(252622)1354614(913)27(28)29h41018H324H212H3(H2526)
MFCD01971950
ZINC000006196131
ZINC000006196133
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