3-(3-phenoxypropylsulfanyl)-5-phenyl-1H-1,2,4-triazole

Systemtic Name: 3-(3-phenoxypropylsulfanyl)-5-phenyl-1H-1,2,4-triazole Openeye Name: 3-(3-phenoxypropylsulfanyl)-5-phenyl-1H-1,2,4-triazole CAS Name: 3-(3-phenoxypropylthio)-5-phenyl-1H-1,2,4-triazole IUPAC Name: 3-(3-phenoxypropylsulfanyl)-5-phenyl-1H-1,2,4-triazole Traditional Name: 3-(3-phenoxypropylthio)-5-phenyl-1H-1,2,4-triazole Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SCCCOC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SCCCOC3=CC=CC=C3

InChI

InChI=1S/C17H17N3OS/c1-3-8-14(9-4-1)16-18-17(20-19-16)22-13-7-12-21-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2,(H,18,19,20)