4-[2-(2-phenylsulfanylphenyl)propyl]-1,2,4-triazole

Systemtic Name: 4-[2-(2-phenylsulfanylphenyl)propyl]-1,2,4-triazole Openeye Name: 4-[2-(2-phenylsulfanylphenyl)propyl]-1,2,4-triazole CAS Name: 4-[2-[2-(phenylthio)phenyl]propyl]-1,2,4-triazole IUPAC Name: 4-[2-(2-phenylsulfanylphenyl)propyl]-1,2,4-triazole Traditional Name: 4-[2-[2-(phenylthio)phenyl]propyl]-1,2,4-triazole Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=NN=C1)C2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

CC(CN1C=NN=C1)C2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C17H17N3S/c1-14(11-20-12-18-19-13-20)16-9-5-6-10-17(16)21-15-7-3-2-4-8-15/h2-10,12-14H,11H2,1H3