N-(4-azanylcyclohexyl)-5-bromanyl-8-[(4-fluorophenyl)methylamino]-1,6-naphthyridine-7-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-5-bromanyl-8-[(4-fluorophenyl)methylamino]-1,6-naphthyridine-7-carboxamide Openeye Name: N-(4-aminocyclohexyl)-5-bromo-8-[(4-fluorophenyl)methylamino]-1,6-naphthyridine-7-carboxamide CAS Name: N-(4-aminocyclohexyl)-5-bromo-8-[(4-fluorophenyl)methylamino]-1,6-naphthyridine-7-carboxamide IUPAC Name: N-(4-aminocyclohexyl)-5-bromo-8-[(4-fluorophenyl)methylamino]-1,6-naphthyridine-7-carboxamide Traditional Name: N-(4-aminocyclohexyl)-5-bromo-8-[(4-fluorobenzyl)amino]-1,6-naphthyridine-7-carboxamide Formula: C22H23BrFN5O MolecularWeight: 472.353323

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=C(C3=C(C=CC=N3)C(=N2)Br)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=C(C3=C(C=CC=N3)C(=N2)Br)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H23BrFN5O/c23-21-17-2-1-11-26-18(17)19(27-12-13-3-5-14(24)6-4-13)20(29-21)22(30)28-16-9-7-15(25)8-10-16/h1-6,11,15-16,27H,7-10,12,25H2,(H,28,30)