5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(quinolin-8-ylamino)-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(quinolin-8-ylamino)-1H-pyrimidin-4-one Openeye Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(8-quinolylamino)-1H-pyrimidin-4-one CAS Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(8-quinolinylamino)-1H-pyrimidin-4-one IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-6-methyl-2-(quinolin-8-ylamino)-1H-pyrimidin-4-one Traditional Name: 5-(4-ethoxybenzyl)-6-methyl-2-(8-quinolylamino)-1H-pyrimidin-4-one Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=C(NC(=NC2=O)NC3=CC=CC4=C3N=CC=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=C(NC(=NC2=O)NC3=CC=CC4=C3N=CC=C4)C

InChI

InChI=1S/C23H22N4O2/c1-3-29-18-11-9-16(10-12-18)14-19-15(2)25-23(27-22(19)28)26-20-8-4-6-17-7-5-13-24-21(17)20/h4-13H,3,14H2,1-2H3,(H2,25,26,27,28)