3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione

Systemtic Name: 3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-1-yl-pyrrolidine-2,5-dione Openeye Name: 3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-(1-naphthyl)pyrrolidine-2,5-dione CAS Name: 3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-(1-naphthalenyl)pyrrolidine-2,5-dione IUPAC Name: 3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-1-naphthalen-1-ylpyrrolidine-2,5-dione Traditional Name: 3-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-1-(1-naphthyl)pyrrolidine-2,5-quinone Formula: C23H18N4O3S MolecularWeight: 430.47902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NN2)SC3CC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NN2)SC3CC(=O)N(C3=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H18N4O3S/c1-30-16-11-9-15(10-12-16)21-24-23(26-25-21)31-19-13-20(28)27(22(19)29)18-8-4-6-14-5-2-3-7-17(14)18/h2-12,19H,13H2,1H3,(H,24,25,26)