Vitas-M small molecule compound
(1Z)-N-{[14-(3,4-dimethoxyphenyl)-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}-1-(4-methylphenyl)ethanimine
Catalog ID
STK270934
SMILES COc1ccc(cc1OC)C1c2c(ncn3c2nc(n3)CO/N=C(\c2ccc(cc2)C)/C)Oc2c1ccc1c2cccc1
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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 C34H29N5O4 MW 571.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H29N5O4/c1-20-9-11-22(12-10-20)21(2)38-42-18-29-36-33-31-30(24-14-16-27(40-3)28(17-24)41-4)26-15-13-23-7-5-6-8-25(23)32(26)43-34(31)35-19-39(33)37-29/h5-17,19,30H,18H2,1-4H3/b38-21-InChIKey
RFXONDIWJWNYBG-GLJXUZQSSA-NSynonyms
(1Z)N((14(34dimethoxyphenyl)14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1(4methylphenyl)ethanimine
CC1=CC=C(C=C1)C(=NOCC2=NN3C=NC4=C(C3=N2)C(C5=C(O4)C6=CC=CC=C6C=C5)C7=CC(=C(C=C7)OC)OC)C
COc1ccc(cc1OC)C1c2c(ncn3c2nc(n3)CON=C(c2ccc(cc2)C)C)Oc2c1ccc1c2cccc1
InChI=1SC34H29N5O4c12091122(121020)21(2)3842182936333130(24141627(403)28(1724)414)26151323756825(23)32(26)4334(31)351939(33)3729h5171930H18H214H3b3821
MFCD04197823
ZINC000097962059
ZINC000097962060
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