3-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one

Systemtic Name: 3-[[4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one Openeye Name: 3-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-1H-quinoxalin-2-one CAS Name: 3-[[4-phenyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one IUPAC Name: 3-[(5-benzylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]-1H-quinoxalin-2-one Traditional Name: 3-[[5-(benzylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-quinoxalin-2-one Formula: C24H19N5OS MolecularWeight: 425.50556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CC4=NC5=CC=CC=C5NC4=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)CC4=NC5=CC=CC=C5NC4=O

InChI

InChI=1S/C24H19N5OS/c30-23-21(25-19-13-7-8-14-20(19)26-23)15-22-27-28-24(29(22)18-11-5-2-6-12-18)31-16-17-9-3-1-4-10-17/h1-14H,15-16H2,(H,26,30)