3-methyl-4-(4-methylphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-methyl-4-(4-methylphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-methyl-5-[(2-phenoxyphenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazole CAS Name: 3-methyl-4-(4-methylphenyl)-5-[(2-phenoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-methyl-4-(4-methylphenyl)-5-[(2-phenoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-methyl-5-[(2-phenoxybenzyl)thio]-4-(p-tolyl)-1,2,4-triazole Formula: C23H21N3OS MolecularWeight: 387.49734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3OC4=CC=CC=C4)C

InChI

InChI=1S/C23H21N3OS/c1-17-12-14-20(15-13-17)26-18(2)24-25-23(26)28-16-19-8-6-7-11-22(19)27-21-9-4-3-5-10-21/h3-15H,16H2,1-2H3