Vitas-M small molecule compound

(1Z)-N-{[14-(4-methoxyphenyl)-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
STK270720
SMILES COc1ccc(cc1)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 C33H27N5O3 MW 541.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H27N5O3/c1-20-8-10-22(11-9-20)21(2)37-40-18-28-35-32-30-29(24-12-15-25(39-3)16-13-24)27-17-14-23-6-4-5-7-26(23)31(27)41-33(30)34-19-38(32)36-28/h4-17,19,29H,18H2,1-3H3/b37-21-
InChIKey
JMWZOHDPLXDKMT-DBSPGSINSA-N
Synonyms

(1Z)N((14(4methoxyphenyl)14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)1(4methylphenyl)ethanimine
(E)1(ptolyl)ethanoneO((14(4methoxyphenyl)14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
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)C
COc1ccc(cc1)C1c2c(ncn3c2nc(n3)CON=C(c2ccc(cc2)C)C)Oc2c1ccc1c2cccc1
InChI=1SC33H27N5O3c12081022(11920)21(2)3740182835323029(24121525(393)161324)27171423645726(23)31(27)4133(30)341938(32)3628h4171929H18H213H3b3721
MFCD07201709
ZINC000097962030
ZINC000097962031

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Available files

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