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

Systemtic Name: 3-(4-methoxyphenyl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(4-methoxyphenyl)-4-methyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-4-methyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-4-methyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(4-methoxyphenyl)-4-methyl-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C18H19N3OS MolecularWeight: 325.42796

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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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3OS/c1-13-4-6-14(7-5-13)12-23-18-20-19-17(21(18)2)15-8-10-16(22-3)11-9-15/h4-11H,12H2,1-3H3