3-[[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]methoxy]-5,6-diphenyl-1,2,4-triazine

Systemtic Name: 3-[[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]methoxy]-5,6-diphenyl-1,2,4-triazine Openeye Name: 3-[[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]methoxy]-5,6-diphenyl-1,2,4-triazine CAS Name: 3-[[3-[(4-chlorophenyl)methylthio]-1H-1,2,4-triazol-5-yl]methoxy]-5,6-diphenyl-1,2,4-triazine IUPAC Name: 3-[[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]methoxy]-5,6-diphenyl-1,2,4-triazine Traditional Name: 3-[[3-[(4-chlorobenzyl)thio]-1H-1,2,4-triazol-5-yl]methoxy]-5,6-diphenyl-1,2,4-triazine Formula: C25H19ClN6OS MolecularWeight: 486.97596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NC(=N2)OCC3=NC(=NN3)SCC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NC(=N2)OCC3=NC(=NN3)SCC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H19ClN6OS/c26-20-13-11-17(12-14-20)16-34-25-27-21(29-32-25)15-33-24-28-22(18-7-3-1-4-8-18)23(30-31-24)19-9-5-2-6-10-19/h1-14H,15-16H2,(H,27,29,32)