Vitas-M small molecule compound
6-amino-4-(4-chloro-3-nitrophenyl)-3-(4-ethoxy-3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL041572
SMILES CCOc1ccc(cc1OC)c1[nH]nc2c1C(c1ccc(c(c1)[N+](=O)[O-])Cl)C(=C(O2)N)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 C22H18ClN5O5 MW 467.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN5O5/c1-3-32-16-7-5-12(9-17(16)31-2)20-19-18(11-4-6-14(23)15(8-11)28(29)30)13(10-24)21(25)33-22(19)27-26-20/h4-9,18H,3,25H2,1-2H3,(H,26,27)InChIKey
GFCQMEJSMIJNJU-UHFFFAOYSA-NSynonyms
849921-53-56amino4(4chloro3nitrophenyl)3(4ethoxy3methoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino4(4chloro3nitrophenyl)3(4ethoxy3methoxyphenyl)24dihydropyrano(23c)pyrazole5carbonitrile
849921535
CCOC1=C(C=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC(=C(C=C4)Cl)(N+)(=O)(O))OC
CCOc1ccc(cc1OC)c1(nH)nc2c1C(c1ccc(c(c1)(N+)(=O)(O))Cl)C(=C(O2)N)C#N
CCOc1ccc(cc1OC)c1n(nH)c2c1C(c1ccc(c(c1)(N+)(=O)(O))Cl)C(=C(O2)N)C#N
InChI=1SC22H18ClN5O5c1332167512(917(16)312)201918(114614(23)15(811)28(29)30)13(1024)21(25)3322(19)272620h4918H325H212H3(H2627)
MFCD05728602
ZINC000009358596
ZINC000009358598
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