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

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole CAS Name: 3-[(4-chlorophenyl)methylthio]-5-phenyl-1H-1,2,4-triazole IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]-5-phenyl-1H-1,2,4-triazole Traditional Name: 3-[(4-chlorobenzyl)thio]-5-phenyl-1H-1,2,4-triazole Formula: C15H12ClN3S MolecularWeight: 301.79388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClN3S/c16-13-8-6-11(7-9-13)10-20-15-17-14(18-19-15)12-4-2-1-3-5-12/h1-9H,10H2,(H,17,18,19)