1-phenyl-2-[[4-phenyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone

Systemtic Name: 1-phenyl-2-[[4-phenyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Openeye Name: 1-phenyl-2-[[4-phenyl-5-(2-phenyl-4-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone CAS Name: 1-phenyl-2-[[4-phenyl-5-(2-phenyl-4-quinolinyl)-1,2,4-triazol-3-yl]thio]ethanone IUPAC Name: 1-phenyl-2-[[4-phenyl-5-(2-phenylquinolin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanone Traditional Name: 1-phenyl-2-[[4-phenyl-5-(2-phenyl-4-quinolyl)-1,2,4-triazol-3-yl]thio]ethanone Formula: C31H22N4OS MolecularWeight: 498.59758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4C5=CC=CC=C5)SCC(=O)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C4=NN=C(N4C5=CC=CC=C5)SCC(=O)C6=CC=CC=C6

InChI

InChI=1S/C31H22N4OS/c36-29(23-14-6-2-7-15-23)21-37-31-34-33-30(35(31)24-16-8-3-9-17-24)26-20-28(22-12-4-1-5-13-22)32-27-19-11-10-18-25(26)27/h1-20H,21H2