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

Systemtic Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(4-methylphenyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-4-phenyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-[(2,5-dimethylphenyl)methylthio]-5-(4-methylphenyl)-4-phenyl-1,2,4-triazole IUPAC Name: 3-[(2,5-dimethylphenyl)methylsulfanyl]-5-(4-methylphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-[(2,5-dimethylbenzyl)thio]-4-phenyl-5-(p-tolyl)-1,2,4-triazole Formula: C24H23N3S MolecularWeight: 385.52452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=C(C=CC(=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=C(C=CC(=C4)C)C

InChI

InChI=1S/C24H23N3S/c1-17-10-13-20(14-11-17)23-25-26-24(27(23)22-7-5-4-6-8-22)28-16-21-15-18(2)9-12-19(21)3/h4-15H,16H2,1-3H3