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

Systemtic Name: 3-(3,4-dimethoxyphenyl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(3,4-dimethoxyphenyl)-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(3,4-dimethoxyphenyl)-4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(3,4-dimethoxyphenyl)-4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O2S/c1-13-5-7-14(8-6-13)12-25-19-21-20-18(22(19)2)15-9-10-16(23-3)17(11-15)24-4/h5-11H,12H2,1-4H3