Vitas-M small molecule compound
4-[6-amino-5-cyano-3-methyl-1-(naphthalen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoic acid
Catalog ID
STK980347
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)C(=O)O)c(C)nn2c1ccc2c(c1)cccc2
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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 C25H18N4O3 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N4O3/c1-14-21-22(16-6-8-17(9-7-16)25(30)31)20(13-26)23(27)32-24(21)29(28-14)19-11-10-15-4-2-3-5-18(15)12-19/h2-12,22H,27H2,1H3,(H,30,31)InChIKey
OBJNBFASDDRQHQ-UHFFFAOYSA-NSynonyms
4(6amino5cyano3methyl1(naphthalen2yl)14dihydropyrano(23c)pyrazol4yl)benzoicacid
4(6AMINO5CYANO3METHYL1NAPHTHALEN2YL4HPYRANO(23C)PYRAZOL4YL)BENZOICACID
CC1=NN(C2=C1C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)O)C4=CC5=CC=CC=C5C=C4
InChI=1SC25H18N4O3c1142122(166817(9716)25(30)31)20(1326)23(27)3224(21)29(2814)19111015423518(15)1219h21222H27H21H3(H3031)
MFCD05988205
ZINC000015016793
ZINC000015016794
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