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

Systemtic Name: 4-[[(2-chlorophenyl)-pyrimidin-2-yl-amino]methyl]-7,8-bis(fluoranyl)-1H-quinolin-2-one Openeye Name: 4-[(2-chloro-N-pyrimidin-2-yl-anilino)methyl]-7,8-difluoro-1H-quinolin-2-one CAS Name: 4-[[2-chloro-N-(2-pyrimidinyl)anilino]methyl]-7,8-difluoro-1H-quinolin-2-one IUPAC Name: 4-[(2-chloro-N-pyrimidin-2-ylanilino)methyl]-7,8-difluoro-1H-quinolin-2-one Traditional Name: 4-[[2-chloro-N-(2-pyrimidyl)anilino]methyl]-7,8-difluoro-carbostyril Formula: C20H13ClF2N4O MolecularWeight: 398.793226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N(CC2=CC(=O)NC3=C2C=CC(=C3F)F)C4=NC=CC=N4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)N(CC2=CC(=O)NC3=C2C=CC(=C3F)F)C4=NC=CC=N4)Cl

InChI

InChI=1S/C20H13ClF2N4O/c21-14-4-1-2-5-16(14)27(20-24-8-3-9-25-20)11-12-10-17(28)26-19-13(12)6-7-15(22)18(19)23/h1-10H,11H2,(H,26,28)