3-[4-(2-bromanyl-4-methyl-phenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one

Systemtic Name: 3-[4-(2-bromanyl-4-methyl-phenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Openeye Name: 3-[4-(2-bromo-4-methyl-phenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one CAS Name: 3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one IUPAC Name: 3-[4-(2-bromo-4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Traditional Name: 3-[4-(2-bromo-4-methyl-phenyl)-5-thioxo-1H-1,2,4-triazol-3-yl]-1-ethyl-7-methyl-1,8-naphthyridin-4-one Formula: C20H18BrN5OS MolecularWeight: 456.35882

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C3=NNC(=S)N3C4=C(C=C(C=C4)C)Br

Isomeric SMILES

CCN1C=C(C(=O)C2=C1N=C(C=C2)C)C3=NNC(=S)N3C4=C(C=C(C=C4)C)Br

InChI

InChI=1S/C20H18BrN5OS/c1-4-25-10-14(17(27)13-7-6-12(3)22-18(13)25)19-23-24-20(28)26(19)16-8-5-11(2)9-15(16)21/h5-10H,4H2,1-3H3,(H,24,28)