5-phenyl-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-phenyl-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-phenyl-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-phenyl-3-[(4-phenylphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-phenyl-3-[(4-phenylphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-phenyl-3-[(4-phenylbenzyl)thio]-1H-1,2,4-triazole Formula: C21H17N3S MolecularWeight: 343.44478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NNC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NNC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H17N3S/c1-3-7-17(8-4-1)18-13-11-16(12-14-18)15-25-21-22-20(23-24-21)19-9-5-2-6-10-19/h1-14H,15H2,(H,22,23,24)