Vitas-M small molecule compound
12-(3,4-dimethoxyphenyl)-2-[({[(1Z)-1-phenylethylidene]amino}oxy)methyl]-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
Catalog ID
STK271024
SMILES COc1ccc(cc1OC)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)CO/N=C(\c1ccccc1)/C)O
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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 C29H25N5O5 MW 523.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5O5/c1-17(18-7-5-4-6-8-18)33-38-15-25-31-28-27-26(19-9-12-22(36-2)24(13-19)37-3)21-11-10-20(35)14-23(21)39-29(27)30-16-34(28)32-25/h4-14,16,26,35H,15H2,1-3H3/b33-17-InChIKey
CCQQQVYWTOHCIE-FZPRHHONSA-NSynonyms
847376-61-8(Z)acetophenoneO((12(34dimethoxyphenyl)9hydroxy12Hchromeno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
12(34dimethoxyphenyl)2(((((1Z)1phenylethylidene)amino)oxy)methyl)12Hchromeno(32e)(124)triazolo(15c)pyrimidin9ol
847376618
CC(=NOCC1=NN2C=NC3=C(C2=N1)C(C4=C(O3)C=C(C=C4)O)C5=CC(=C(C=C5)OC)OC)C6=CC=CC=C6
COc1ccc(cc1OC)C1c2ccc(cc2Oc2c1c1nc(nn1cn2)CON=C(c1ccccc1)C)O
InChI=1SC29H25N5O5c117(187546818)3338152531282726(1991222(362)24(1319)373)21111020(35)1423(21)3929(27)301634(28)3225h414162635H15H213H3b3317
MFCD04181187
ZINC000009158980
ZINC000009584254
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