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

Systemtic Name: 4-[(4-chlorophenyl)methyl]-3-phenyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 4-[(4-chlorophenyl)methyl]-3-phenyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-[(4-chlorophenyl)methyl]-3-phenyl-5-[(4-phenylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 4-[(4-chlorophenyl)methyl]-3-phenyl-5-[(4-phenylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-(4-chlorobenzyl)-3-phenyl-5-[(4-phenylbenzyl)thio]-1,2,4-triazole Formula: C28H22ClN3S MolecularWeight: 468.01238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(N3CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CSC3=NN=C(N3CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C28H22ClN3S/c29-26-17-13-21(14-18-26)19-32-27(25-9-5-2-6-10-25)30-31-28(32)33-20-22-11-15-24(16-12-22)23-7-3-1-4-8-23/h1-18H,19-20H2