Vitas-M small molecule compound
(E)-1-(4-methoxyphenyl)-N-[(14-phenyl-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)methoxy]methanimine
Catalog ID
STL056989
SMILES COc1ccc(cc1)/C=N/OCc1nc2n(n1)cnc1c2C(c2ccccc2)c2c(O1)c1ccccc1cc2
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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/c1-37-23-14-11-20(12-15-23)17-33-38-18-26-34-30-28-27(22-8-3-2-4-9-22)25-16-13-21-7-5-6-10-24(21)29(25)39-31(28)32-19-36(30)35-26/h2-17,19,27H,18H2,1H3/b33-17+InChIKey
XOJSHHVLRJQLRH-ATZGPIRCSA-NSynonyms
846065-10-9(E)1(4methoxyphenyl)N((14phenyl14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)methanimine
(E)4methoxybenzaldehydeO((14phenyl14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
846065109
COC1=CC=C(C=C1)C=NOCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)C6=CC=CC=C6C=C5)C7=CC=CC=C7
COc1ccc(cc1)C=NOCc1nc2n(n1)cnc1c2C(c2ccccc2)c2c(O1)c1ccccc1cc2
InChI=1SC31H23N5O3c13723141120(121523)173338182634302827(228324922)251613217561024(21)29(25)3931(28)321936(30)3526h2171927H18H21H3b3317+
MFCD04173998
ZINC000013770097
ZINC000013770099
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