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

Systemtic Name: 3-(4-methoxyphenyl)-2-methyl-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one Openeye Name: 3-(4-methoxyphenyl)-2-methyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one CAS Name: 3-(4-methoxyphenyl)-2-methyl-7-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]-1-benzopyran-4-one IUPAC Name: 3-(4-methoxyphenyl)-2-methyl-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)-2-methyl-chromone Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H26N4O5/c1-18-25(19-4-6-20(34-2)7-5-19)26(33)22-9-8-21(16-23(22)36-18)35-17-24(32)30-12-14-31(15-13-30)27-28-10-3-11-29-27/h3-11,16H,12-15,17H2,1-2H3