Vitas-M small molecule compound
(1E)-N-{[11-(furan-2-yl)-10-methyl-8-phenyl-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)ethanimine
Catalog ID
STK585455
SMILES COc1ccc(cc1)/C(=N/OCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1)/C
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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 C30H25N7O4 MW 547.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N7O4/c1-18(20-11-13-22(38-3)14-12-20)35-40-16-24-32-28-27-26(23-10-7-15-39-23)25-19(2)33-37(21-8-5-4-6-9-21)30(25)41-29(27)31-17-36(28)34-24/h4-15,17,26H,16H2,1-3H3/b35-18+InChIKey
WHICVGKEUWUGOU-MWBNBJEGSA-NSynonyms
(1E)N((11(furan2yl)10methyl8phenyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1(4methoxyphenyl)ethanimine
(Z)1(4methoxyphenyl)ethanoneO((11(furan2yl)10methyl8phenyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
CC1=NN(C2=C1C(C3=C(O2)N=CN4C3=NC(=N4)CON=C(C)C5=CC=C(C=C5)OC)C6=CC=CO6)C7=CC=CC=C7
COc1ccc(cc1)C(=NOCc1nn2c(n1)c1c(nc2)Oc2c(C1c1ccco1)c(C)nn2c1ccccc1)C
InChI=1SC30H25N7O4c118(20111322(383)141220)3540162432282726(23107153923)2519(2)3337(218546921)30(25)4129(27)311736(28)3424h4151726H16H213H3b3518+
MFCD18158282
ZINC000097968096
ZINC000097968097
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