Vitas-M small molecule compound
(E)-1-(2-chlorophenyl)-N-{[14-(4-methoxyphenyl)-14H-benzo[7,8]chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl]methoxy}methanimine
Catalog ID
STK270715
SMILES COc1ccc(cc1)C1c2c(ncn3c2nc(n3)CO/N=C/c2ccccc2Cl)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 C31H22ClN5O3 MW 548.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22ClN5O3/c1-38-22-13-10-20(11-14-22)27-24-15-12-19-6-2-4-8-23(19)29(24)40-31-28(27)30-35-26(36-37(30)18-33-31)17-39-34-16-21-7-3-5-9-25(21)32/h2-16,18,27H,17H2,1H3/b34-16+InChIKey
WMXJYCDDKAYKHM-AABVJFSESA-NSynonyms
847270-03-5(E)1(2chlorophenyl)N((14(4methoxyphenyl)14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methoxy)methanimine
(E)2chlorobenzaldehydeO((14(4methoxyphenyl)14Hbenzo(78)chromeno(32e)(124)triazolo(15c)pyrimidin2yl)methyl)oxime
847270035
COC1=CC=C(C=C1)C2C3=C(C4=CC=CC=C4C=C3)OC5=C2C6=NC(=NN6C=N5)CON=CC7=CC=CC=C7Cl
COc1ccc(cc1)C1c2c(ncn3c2nc(n3)CON=Cc2ccccc2Cl)Oc2c1ccc1c2cccc1
InChI=1SC31H22ClN5O3c13822131020(111422)2724151219624823(19)29(24)403128(27)303526(3637(30)183331)1739341621735925(21)32h2161827H17H21H3b3416+
MFCD04179058
ZINC000097954540
ZINC000097954541
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