Vitas-M small molecule compound
6-amino-4-(5-chloro-2-hydroxyphenyl)-3-(4-ethoxy-3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL053424
SMILES CCOc1ccc(cc1OC)c1[nH]nc2c1C(C(=C(O2)N)C#N)c1cc(Cl)ccc1O
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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 C22H19ClN4O4 MW 438.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O4/c1-3-30-16-7-4-11(8-17(16)29-2)20-19-18(13-9-12(23)5-6-15(13)28)14(10-24)21(25)31-22(19)27-26-20/h4-9,18,28H,3,25H2,1-2H3,(H,26,27)InChIKey
ZIXDIYUTPBSVNJ-UHFFFAOYSA-NSynonyms
862245-31-66amino4(5chloro2hydroxyphenyl)3(4ethoxy3methoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino4(5chloro2hydroxyphenyl)3(4ethoxy3methoxyphenyl)24dihydropyrano(23c)pyrazole5carbonitrile
862245316
CCOC1=C(C=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=C(C=CC(=C4)Cl)O)OC
CCOc1ccc(cc1OC)c1(nH)nc2c1C(C(=C(O2)N)C#N)c1cc(Cl)ccc1O
CCOc1ccc(cc1OC)c1n(nH)c2c1C(C(=C(O2)N)C#N)c1cc(Cl)ccc1O
InChI=1SC22H19ClN4O4c1330167411(817(16)292)201918(13912(23)5615(13)28)14(1024)21(25)3122(19)272620h491828H325H212H3(H2627)
MFCD05738252
ZINC000009292257
ZINC000009292258
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