4-[(2-bromanyl-5-methoxy-phenyl)methylsulfanyl]-1-phenyl-1,8-naphthyridin-2-one

Systemtic Name: 4-[(2-bromanyl-5-methoxy-phenyl)methylsulfanyl]-1-phenyl-1,8-naphthyridin-2-one Openeye Name: 4-[(2-bromo-5-methoxy-phenyl)methylsulfanyl]-1-phenyl-1,8-naphthyridin-2-one CAS Name: 4-[(2-bromo-5-methoxyphenyl)methylthio]-1-phenyl-1,8-naphthyridin-2-one IUPAC Name: 4-[(2-bromo-5-methoxyphenyl)methylsulfanyl]-1-phenyl-1,8-naphthyridin-2-one Traditional Name: 4-[(2-bromo-5-methoxy-benzyl)thio]-1-phenyl-1,8-naphthyridin-2-one Formula: C22H17BrN2O2S MolecularWeight: 453.35158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CSC2=CC(=O)N(C3=C2C=CC=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CSC2=CC(=O)N(C3=C2C=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C22H17BrN2O2S/c1-27-17-9-10-19(23)15(12-17)14-28-20-13-21(26)25(16-6-3-2-4-7-16)22-18(20)8-5-11-24-22/h2-13H,14H2,1H3