3-[[2-(4-bromophenyl)ethylamino]methyl]-2-thiophen-3-yl-6H-1,6-naphthyridin-7-one

Systemtic Name: 3-[[2-(4-bromophenyl)ethylamino]methyl]-2-thiophen-3-yl-6H-1,6-naphthyridin-7-one Openeye Name: 3-[[2-(4-bromophenyl)ethylamino]methyl]-2-(3-thienyl)-6H-1,6-naphthyridin-7-one CAS Name: 3-[[2-(4-bromophenyl)ethylamino]methyl]-2-(3-thiophenyl)-6H-1,6-naphthyridin-7-one IUPAC Name: 3-[[2-(4-bromophenyl)ethylamino]methyl]-2-thiophen-3-yl-6H-1,6-naphthyridin-7-one Traditional Name: 3-[[2-(4-bromophenyl)ethylamino]methyl]-2-(3-thienyl)-6H-1,6-naphthyridin-7-one Formula: C21H18BrN3OS MolecularWeight: 440.35612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNCC2=CC3=CNC(=O)C=C3N=C2C4=CSC=C4)Br

Isomeric SMILES

C1=CC(=CC=C1CCNCC2=CC3=CNC(=O)C=C3N=C2C4=CSC=C4)Br

InChI

InChI=1S/C21H18BrN3OS/c22-18-3-1-14(2-4-18)5-7-23-11-17-9-16-12-24-20(26)10-19(16)25-21(17)15-6-8-27-13-15/h1-4,6,8-10,12-13,23H,5,7,11H2,(H,24,26)