4-[[(3-chlorophenyl)-pyrimidin-4-yl-amino]methyl]-8-fluoranyl-1H-quinolin-2-one

Systemtic Name: 4-[[(3-chlorophenyl)-pyrimidin-4-yl-amino]methyl]-8-fluoranyl-1H-quinolin-2-one Openeye Name: 4-[(3-chloro-N-pyrimidin-4-yl-anilino)methyl]-8-fluoro-1H-quinolin-2-one CAS Name: 4-[[3-chloro-N-(4-pyrimidinyl)anilino]methyl]-8-fluoro-1H-quinolin-2-one IUPAC Name: 4-[(3-chloro-N-pyrimidin-4-ylanilino)methyl]-8-fluoro-1H-quinolin-2-one Traditional Name: 4-[[3-chloro-N-(4-pyrimidyl)anilino]methyl]-8-fluoro-carbostyril Formula: C20H14ClFN4O MolecularWeight: 380.802763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClFN4O/c21-14-3-1-4-15(10-14)26(18-7-8-23-12-24-18)11-13-9-19(27)25-20-16(13)5-2-6-17(20)22/h1-10,12H,11H2,(H,25,27)