tert-butyl 4-[5-bromanyl-7-[(4-fluorophenyl)methylcarbamoyl]-1,6-naphthyridin-8-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-bromanyl-7-[(4-fluorophenyl)methylcarbamoyl]-1,6-naphthyridin-8-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-bromo-7-[(4-fluorophenyl)methylcarbamoyl]-1,6-naphthyridin-8-yl]piperazine-1-carboxylate CAS Name: 4-[5-bromo-7-[[(4-fluorophenyl)methylamino]-oxomethyl]-1,6-naphthyridin-8-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-bromo-7-[(4-fluorophenyl)methylcarbamoyl]-1,6-naphthyridin-8-yl]piperazine-1-carboxylate Traditional Name: 4-[5-bromo-7-[(4-fluorobenzyl)carbamoyl]-1,6-naphthyridin-8-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H27BrFN5O3 MolecularWeight: 544.415983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(N=C(C3=C2N=CC=C3)Br)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C(N=C(C3=C2N=CC=C3)Br)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C25H27BrFN5O3/c1-25(2,3)35-24(34)32-13-11-31(12-14-32)21-19-18(5-4-10-28-19)22(26)30-20(21)23(33)29-15-16-6-8-17(27)9-7-16/h4-10H,11-15H2,1-3H3,(H,29,33)