Vitas-M small molecule compound

(1Z)-N-{[11-(4-methoxyphenyl)-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-methylphenyl)ethanimine

Catalog ID
STK270668
SMILES COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CO/N=C(\c1ccc(cc1)C)/C)c1ccccc1

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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 C33H29N7O3 MW 571.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N7O3/c1-20-10-12-23(13-11-20)21(2)38-42-18-27-35-31-30-29(24-14-16-26(41-4)17-15-24)28-22(3)36-40(25-8-6-5-7-9-25)33(28)43-32(30)34-19-39(31)37-27/h5-17,19,29H,18H2,1-4H3/b38-21-
InChIKey
XHHPQLSADYQUMK-GLJXUZQSSA-N
Synonyms

(1Z)N((11(4methoxyphenyl)10methyl8phenyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1(4methylphenyl)ethanimine
(Z)1(ptolyl)ethanoneO((11(4methoxyphenyl)10methyl8phenyl811dihydropyrazolo(4356)pyrano(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
CC1=CC=C(C=C1)C(=NOCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)N(N=C5C)C6=CC=CC=C6)C7=CC=C(C=C7)OC)C
COc1ccc(cc1)C1c2c(C)nn(c2Oc2c1c1nc(nn1cn2)CON=C(c1ccc(cc1)C)C)c1ccccc1
InChI=1SC33H29N7O3c120101223(131120)21(2)3842182735313029(24141626(414)171524)2822(3)3640(258657925)33(28)4332(30)341939(31)3727h5171929H18H214H3b3821
MFCD04185894
ZINC000097962023
ZINC000097962024

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Available files

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