3-phenethylsulfanyl-5-phenyl-1H-1,2,4-triazole

Systemtic Name: 3-phenethylsulfanyl-5-phenyl-1H-1,2,4-triazole Openeye Name: 3-phenethylsulfanyl-5-phenyl-1H-1,2,4-triazole CAS Name: 3-(phenethylthio)-5-phenyl-1H-1,2,4-triazole IUPAC Name: 3-phenethylsulfanyl-5-phenyl-1H-1,2,4-triazole Traditional Name: 3-(phenethylthio)-5-phenyl-1H-1,2,4-triazole Formula: C16H15N3S MolecularWeight: 281.3754

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3S/c1-3-7-13(8-4-1)11-12-20-16-17-15(18-19-16)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,17,18,19)