Vitas-M small molecule compound
(E)-N-{[14-(4-methoxyphenyl)-14H-benzo[5,6]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-phenylmethanimine
Catalog ID
STK270763
SMILES COc1ccc(cc1)C1c2c(ccc3c2cccc3)Oc2c1c1nc(nn1cn2)CO/N=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 C31H23N5O3 MW 513.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23N5O3/c1-37-23-14-11-22(12-15-23)27-28-24-10-6-5-9-21(24)13-16-25(28)39-31-29(27)30-34-26(35-36(30)19-32-31)18-38-33-17-20-7-3-2-4-8-20/h2-17,19,27H,18H2,1H3/b33-17+InChIKey
BFVVIKQZORUZPC-ATZGPIRCSA-NSynonyms
848735-94-4(E)benzaldehydeO((14(4methoxyphenyl)14Hbenzo(56)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
(E)N((14(4methoxyphenyl)14Hbenzo(56)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1phenylmethanimine
848735944
COC1=CC=C(C=C1)C2C3=C(C=CC4=CC=CC=C43)OC5=C2C6=NC(=NN6C=N5)CON=CC7=CC=CC=C7
COc1ccc(cc1)C1c2c(ccc3c2cccc3)Oc2c1c1nc(nn1cn2)CON=Cc1ccccc1
InChI=1SC31H23N5O3c13723141122(121523)2728241065921(24)131625(28)393129(27)303426(3536(30)193231)18383317207324820h2171927H18H21H3b3317+
MFCD04194505
ZINC000008687238
ZINC000008687240
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