N'-[7-(3-bromanyl-4-morpholin-4-yl-phenyl)-1,6-naphthyridin-5-yl]propane-1,3-diamine

Systemtic Name: N'-[7-(3-bromanyl-4-morpholin-4-yl-phenyl)-1,6-naphthyridin-5-yl]propane-1,3-diamine Openeye Name: N'-[7-(3-bromo-4-morpholino-phenyl)-1,6-naphthyridin-5-yl]propane-1,3-diamine CAS Name: N'-[7-[3-bromo-4-(4-morpholinyl)phenyl]-1,6-naphthyridin-5-yl]propane-1,3-diamine IUPAC Name: N'-[7-(3-bromo-4-morpholin-4-ylphenyl)-1,6-naphthyridin-5-yl]propane-1,3-diamine Traditional Name: 3-aminopropyl-[7-(3-bromo-4-morpholino-phenyl)-1,6-naphthyridin-5-yl]amine Formula: C21H24BrN5O MolecularWeight: 442.35216

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C3=NC(=C4C=CC=NC4=C3)NCCCN)Br

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C3=NC(=C4C=CC=NC4=C3)NCCCN)Br

InChI

InChI=1S/C21H24BrN5O/c22-17-13-15(4-5-20(17)27-9-11-28-12-10-27)18-14-19-16(3-1-7-24-19)21(26-18)25-8-2-6-23/h1,3-5,7,13-14H,2,6,8-12,23H2,(H,25,26)