Vitas-M small molecule compound
methyl 4-(6-amino-3-tert-butyl-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
Catalog ID
STK763235
SMILES COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1c(n[nH]2)C(C)(C)C)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 C19H20N4O3 MW 352.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O3/c1-19(2,3)15-14-13(10-5-7-11(8-6-10)18(24)25-4)12(9-20)16(21)26-17(14)23-22-15/h5-8,13H,21H2,1-4H3,(H,22,23)InChIKey
OKPREUAJSKLLKS-UHFFFAOYSA-NSynonyms
CC(C)(C)C1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC=C(C=C3)C(=O)OC
COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1c(n(nH)2)C(C)(C)C)C#N
InChI=1SC19H20N4O3c119(23)151413(105711(8610)18(24)254)12(920)16(21)2617(14)232215h5813H21H214H3(H2223)
METHYL4(6AMINO3(TERTBUTYL)5CYANO4HPYRANO(32D)PYRAZOL4YL)BENZOATE
methyl4(6amino3tertbutyl5cyano14dihydropyrano(23c)pyrazol4yl)benzoate
METHYL4(6AMINO3TERTBUTYL5CYANO24DIHYDROPYRANO(23C)PYRAZOL4YL)BENZOATE
MFCD02647085
ZINC000000709678
ZINC000000709679
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