3-(4-chlorophenyl)-5-(diphenylmethyl)sulfanyl-4-(2-methylphenyl)-1,2,4-triazole

Systemtic Name: 3-(4-chlorophenyl)-5-(diphenylmethyl)sulfanyl-4-(2-methylphenyl)-1,2,4-triazole Openeye Name: 3-benzhydrylsulfanyl-5-(4-chlorophenyl)-4-(o-tolyl)-1,2,4-triazole CAS Name: 3-(4-chlorophenyl)-5-[(diphenylmethyl)thio]-4-(2-methylphenyl)-1,2,4-triazole IUPAC Name: 3-benzhydrylsulfanyl-5-(4-chlorophenyl)-4-(2-methylphenyl)-1,2,4-triazole Traditional Name: 3-(benzhydrylthio)-5-(4-chlorophenyl)-4-(o-tolyl)-1,2,4-triazole Formula: C28H22ClN3S MolecularWeight: 468.01238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=C2SC(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=C2SC(C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H22ClN3S/c1-20-10-8-9-15-25(20)32-27(23-16-18-24(29)19-17-23)30-31-28(32)33-26(21-11-4-2-5-12-21)22-13-6-3-7-14-22/h2-19,26H,1H3