3-(4-methylphenyl)-4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(4-methylphenyl)-4-phenyl-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-benzylsulfanyl-4-phenyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-methylphenyl)-4-phenyl-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 3-benzylsulfanyl-5-(4-methylphenyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(benzylthio)-4-phenyl-5-(p-tolyl)-1,2,4-triazole Formula: C22H19N3S MolecularWeight: 357.47136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19N3S/c1-17-12-14-19(15-13-17)21-23-24-22(25(21)20-10-6-3-7-11-20)26-16-18-8-4-2-5-9-18/h2-15H,16H2,1H3