Vitas-M small molecule compound
methyl 4-{3,5-dichloro-4-[(2-cyanobenzyl)oxy]phenyl}-2-methyl-5-oxo-4,5-dihydro-1H-indeno[1,2-b]pyridine-3-carboxylate
Catalog ID
STL374205
SMILES COC(=O)C1=C(C)NC2=C(C1c1cc(Cl)c(c(c1)Cl)OCc1ccccc1C#N)C(=O)c1c2cccc1
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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 C29H20Cl2N2O4 MW 531.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20Cl2N2O4/c1-15-23(29(35)36-2)24(25-26(33-15)19-9-5-6-10-20(19)27(25)34)18-11-21(30)28(22(31)12-18)37-14-17-8-4-3-7-16(17)13-32/h3-12,24,33H,14H2,1-2H3InChIKey
WJUVFHQIWWJYOF-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC(=C(C(=C4)Cl)OCC5=CC=CC=C5C#N)Cl)C(=O)OC
InChI=1SC29H20Cl2N2O4c11523(29(35)362)24(2526(3315)199561020(19)27(25)34)181121(30)28(22(31)1218)371417843716(17)1332h3122433H14H212H3
methyl4(35dichloro4((2cyanobenzyl)oxy)phenyl)2methyl5oxo45dihydro1Hindeno(12b)pyridine3carboxylate
METHYL4(35DICHLORO4((2CYANOPHENYL)METHOXY)PHENYL)2METHYL5OXO14DIHYDROINDENO(12B)PYRIDINE3CARBOXYLATE
METHYL4(35DICHLORO4((2CYANOPHENYL)METHOXY)PHENYL)2METHYL5OXO14DIHYDROINDENO(32B)PYRIDINE3CARBOXYLATE
MFCD02228764
ZINC000100215075
ZINC000100215078
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