3-butylsulfanyl-4-(3-methylphenyl)-5-phenyl-1,2,4-triazole

Systemtic Name: 3-butylsulfanyl-4-(3-methylphenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-butylsulfanyl-4-(m-tolyl)-5-phenyl-1,2,4-triazole CAS Name: 3-(butylthio)-4-(3-methylphenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-butylsulfanyl-4-(3-methylphenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-(butylthio)-4-(m-tolyl)-5-phenyl-1,2,4-triazole Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(N1C2=CC=CC(=C2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCSC1=NN=C(N1C2=CC=CC(=C2)C)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3S/c1-3-4-13-23-19-21-20-18(16-10-6-5-7-11-16)22(19)17-12-8-9-15(2)14-17/h5-12,14H,3-4,13H2,1-2H3