7,8-bis(fluoranyl)-4-[[(phenylmethyl)-pyrimidin-4-yl-amino]methyl]-1H-quinolin-2-one

Systemtic Name: 7,8-bis(fluoranyl)-4-[[(phenylmethyl)-pyrimidin-4-yl-amino]methyl]-1H-quinolin-2-one Openeye Name: 4-[[benzyl(pyrimidin-4-yl)amino]methyl]-7,8-difluoro-1H-quinolin-2-one CAS Name: 7,8-difluoro-4-[[(phenylmethyl)-(4-pyrimidinyl)amino]methyl]-1H-quinolin-2-one IUPAC Name: 4-[[benzyl(pyrimidin-4-yl)amino]methyl]-7,8-difluoro-1H-quinolin-2-one Traditional Name: 4-[[benzyl(4-pyrimidyl)amino]methyl]-7,8-difluoro-carbostyril Formula: C21H16F2N4O MolecularWeight: 378.374746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC(=O)NC3=C2C=CC(=C3F)F)C4=NC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC(=O)NC3=C2C=CC(=C3F)F)C4=NC=NC=C4

InChI

InChI=1S/C21H16F2N4O/c22-17-7-6-16-15(10-19(28)26-21(16)20(17)23)12-27(18-8-9-24-13-25-18)11-14-4-2-1-3-5-14/h1-10,13H,11-12H2,(H,26,28)