4-(phenylmethyl)-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(phenylmethyl)-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-benzyl-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one CAS Name: 4-(phenylmethyl)-3-[(4-phenylphenyl)methylthio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-benzyl-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-benzyl-3-[(4-phenylbenzyl)thio]-1H-1,2,4-triazol-5-one Formula: C22H19N3OS MolecularWeight: 373.47076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)NN=C2SCC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)NN=C2SCC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H19N3OS/c26-21-23-24-22(25(21)15-17-7-3-1-4-8-17)27-16-18-11-13-20(14-12-18)19-9-5-2-6-10-19/h1-14H,15-16H2,(H,23,26)