Vitas-M small molecule compound
ethyl 7-{4-[(2,6-dichlorobenzyl)oxy]-3-methoxyphenyl}-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Catalog ID
STK154136
SMILES CCOC(=O)C1=C(Nc2n(C1c1ccc(c(c1)OC)OCc1c(Cl)cccc1Cl)ncn2)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 C28H24Cl2N4O4 MW 551.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24Cl2N4O4/c1-3-37-27(35)24-25(17-8-5-4-6-9-17)33-28-31-16-32-34(28)26(24)18-12-13-22(23(14-18)36-2)38-15-19-20(29)10-7-11-21(19)30/h4-14,16,26H,3,15H2,1-2H3,(H,31,32,33)InChIKey
WFHUYCXJYBGJOR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N=C2N=CNN2C1C3=CC(=C(C=C3)OCC4=C(C=CC=C4Cl)Cl)OC)C5=CC=CC=C5
ETHYL7(4((26DICHLOROBENZYL)OXY)3METHOXYPHENYL)5PHENYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7(4((26DICHLOROPHENYL)METHOXY)3METHOXYPHENYL)5PHENYL17DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
ETHYL7(4(26DICHLOROBENZYLOXY)3METHOXYPHENYL)5PHENYL47DIHYDRO(124)TRIAZOLO(15A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H24Cl2N4O4c133727(35)2425(178546917)332831163234(28)26(24)18121322(23(1418)362)38151920(29)1071121(19)30h4141626H315H212H3(H313233)
MFCD04560696
ZINC000003770937
ZINC000003770938
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