2-phenyl-5-(phenylmethylsulfanyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-phenyl-5-(phenylmethylsulfanyl)-1H-1,2,4-triazol-3-one Openeye Name: 5-benzylsulfanyl-2-phenyl-1H-1,2,4-triazol-3-one CAS Name: 2-phenyl-5-(phenylmethylthio)-1H-1,2,4-triazol-3-one IUPAC Name: 5-benzylsulfanyl-2-phenyl-1H-1,2,4-triazol-3-one Traditional Name: 5-(benzylthio)-2-phenyl-1H-1,2,4-triazol-3-one Formula: C15H13N3OS MolecularWeight: 283.34822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C15H13N3OS/c19-15-16-14(20-11-12-7-3-1-4-8-12)17-18(15)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,17,19)