6-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]chromen-4-one

Systemtic Name: 6-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]chromen-4-one Openeye Name: 6-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]chromen-4-one CAS Name: 6-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butoxy]-1-benzopyran-4-one IUPAC Name: 6-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butoxy]chromen-4-one Traditional Name: 6-[4-[4-(2-pyrimidyl)piperazino]butoxy]chromone Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=CC3=C(C=C2)OC=CC3=O)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCCOC2=CC3=C(C=C2)OC=CC3=O)C4=NC=CC=N4

InChI

InChI=1S/C21H24N4O3/c26-19-6-15-28-20-5-4-17(16-18(19)20)27-14-2-1-9-24-10-12-25(13-11-24)21-22-7-3-8-23-21/h3-8,15-16H,1-2,9-14H2