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

Systemtic Name: 3-(4-methylphenyl)-5-(2-methylpropylsulfanyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-isobutylsulfanyl-4-phenyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-methylphenyl)-5-(2-methylpropylthio)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(4-methylphenyl)-5-(2-methylpropylsulfanyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(isobutylthio)-4-phenyl-5-(p-tolyl)-1,2,4-triazole Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(C)C

InChI

InChI=1S/C19H21N3S/c1-14(2)13-23-19-21-20-18(16-11-9-15(3)10-12-16)22(19)17-7-5-4-6-8-17/h4-12,14H,13H2,1-3H3