Vitas-M small molecule compound
6-amino-3-(4-ethoxy-3-methoxyphenyl)-4-(2-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK568502
SMILES CCOc1ccc(cc1OC)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1ccccc1[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 C22H19N5O5 MW 433.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O5/c1-3-31-16-9-8-12(10-17(16)30-2)20-19-18(13-6-4-5-7-15(13)27(28)29)14(11-23)21(24)32-22(19)26-25-20/h4-10,18H,3,24H2,1-2H3,(H,25,26)InChIKey
UTRTWTFYHHLURF-UHFFFAOYSA-NSynonyms
862193-45-16amino3(4ethoxy3methoxyphenyl)4(2nitrophenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino3(4ethoxy3methoxyphenyl)4(2nitrophenyl)24dihydropyrano(23c)pyrazole5carbonitrile
862193451
CCOC1=C(C=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=CC=C4(N+)(=O)(O))OC
CCOc1ccc(cc1OC)c1(nH)nc2c1C(C(=C(O2)N)C#N)c1ccccc1(N+)(=O)(O)
CCOc1ccc(cc1OC)c1n(nH)c2c1C(C(=C(O2)N)C#N)c1ccccc1(N+)(=O)(O)
InChI=1SC22H19N5O5c1331169812(1017(16)302)201918(13645715(13)27(28)29)14(1123)21(24)3222(19)262520h41018H324H212H3(H2526)
MFCD05727212
ZINC000009244222
ZINC000009244223
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