Vitas-M small molecule compound
(E)-N-{[8-(4-chlorophenyl)-11-(furan-2-yl)-10-methyl-8,11-dihydropyrazolo[4',3':5,6]pyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-(4-methoxyphenyl)methanimine
Catalog ID
STK588596
SMILES COc1ccc(cc1)/C=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccc(cc1)Cl
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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 C29H22ClN7O4 MW 567.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H22ClN7O4/c1-17-24-25(22-4-3-13-39-22)26-27-33-23(15-40-32-14-18-5-11-21(38-2)12-6-18)35-36(27)16-31-28(26)41-29(24)37(34-17)20-9-7-19(30)8-10-20/h3-14,16,25H,15H2,1-2H3/b32-14+InChIKey
AKUNBQLBGDDJON-HIWRWHBISA-NSynonyms
(E)4methoxybenzaldehydeO((8(4chlorophenyl)11(furan2yl)10methyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
(E)N((8(4chlorophenyl)11(furan2yl)10methyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1(4methoxyphenyl)methanimine
CC1=NN(C2=C1C(C3=C(O2)N=CN4C3=NC(=N4)CON=CC5=CC=C(C=C5)OC)C6=CC=CO6)C7=CC=C(C=C7)Cl
COc1ccc(cc1)C=NOCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccc(cc1)Cl
InChI=1SC29H22ClN7O4c1172425(2243133922)26273323(154032141851121(382)12618)3536(27)163128(26)4129(24)37(3417)209719(30)81020h3141625H15H212H3b3214+
MFCD07212479
ZINC000097968148
ZINC000097968149
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