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

Systemtic Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-4-methyl-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[(2-methoxy-5-methylphenyl)methylthio]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-[(2-methoxy-5-methylphenyl)methylsulfanyl]-4-methyl-5-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-[(2-methoxy-5-methyl-benzyl)thio]-4-methyl-5-(o-tolyl)-1,2,4-triazole Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2C)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2C)C3=CC=CC=C3C

InChI

InChI=1S/C19H21N3OS/c1-13-9-10-17(23-4)15(11-13)12-24-19-21-20-18(22(19)3)16-8-6-5-7-14(16)2/h5-11H,12H2,1-4H3