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

Systemtic Name: 7-methoxy-4-methyl-3-[3-oxidanylidene-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]chromen-2-one Openeye Name: 7-methoxy-4-methyl-3-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]chromen-2-one CAS Name: 7-methoxy-4-methyl-3-[3-oxo-3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-methyl-3-[3-oxo-3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]chromen-2-one Traditional Name: 3-[3-keto-3-[4-(2-pyrimidyl)piperazino]propyl]-7-methoxy-4-methyl-coumarin Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H24N4O4/c1-15-17-5-4-16(29-2)14-19(17)30-21(28)18(15)6-7-20(27)25-10-12-26(13-11-25)22-23-8-3-9-24-22/h3-5,8-9,14H,6-7,10-13H2,1-2H3