3-(4-methoxyphenyl)-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one

Systemtic Name: 3-(4-methoxyphenyl)-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one Openeye Name: 3-(4-methoxyphenyl)-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one CAS Name: 3-(4-methoxyphenyl)-7-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]-1-benzopyran-4-one IUPAC Name: 3-(4-methoxyphenyl)-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one Traditional Name: 7-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethoxy]-3-(4-methoxyphenyl)chromone Formula: C26H24N4O5 MolecularWeight: 472.49256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

COC1=CC=C(C=C1)C2=COC3=C(C2=O)C=CC(=C3)OCC(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C26H24N4O5/c1-33-19-5-3-18(4-6-19)22-16-35-23-15-20(7-8-21(23)25(22)32)34-17-24(31)29-11-13-30(14-12-29)26-27-9-2-10-28-26/h2-10,15-16H,11-14,17H2,1H3