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

Systemtic Name: 3-(4-methylphenyl)-4-phenyl-5-phenylsulfanyl-1,2,4-triazole Openeye Name: 4-phenyl-3-phenylsulfanyl-5-(p-tolyl)-1,2,4-triazole CAS Name: 3-(4-methylphenyl)-4-phenyl-5-(phenylthio)-1,2,4-triazole IUPAC Name: 3-(4-methylphenyl)-4-phenyl-5-phenylsulfanyl-1,2,4-triazole Traditional Name: 4-phenyl-3-(phenylthio)-5-(p-tolyl)-1,2,4-triazole Formula: C21H17N3S MolecularWeight: 343.44478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C21H17N3S/c1-16-12-14-17(15-13-16)20-22-23-21(25-19-10-6-3-7-11-19)24(20)18-8-4-2-5-9-18/h2-15H,1H3