1-[[4-[2,5-bis(chloranyl)phenyl]-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-(3-chlorophenyl)urea

Systemtic Name: 1-[[4-[2,5-bis(chloranyl)phenyl]-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-(3-chlorophenyl)urea Openeye Name: 1-(3-chlorophenyl)-3-[[4-(2,5-dichlorophenyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]urea CAS Name: 1-(3-chlorophenyl)-3-[[4-(2,5-dichlorophenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]urea IUPAC Name: 1-(3-chlorophenyl)-3-[[4-(2,5-dichlorophenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]urea Traditional Name: 1-(3-chlorophenyl)-3-[[4-(2,5-dichlorophenyl)-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]urea Formula: C24H20Cl3N5OS MolecularWeight: 532.8725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)CNC(=O)NC4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=CC=C1CSC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)CNC(=O)NC4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H20Cl3N5OS/c1-15-5-2-3-6-16(15)14-34-24-31-30-22(32(24)21-12-18(26)9-10-20(21)27)13-28-23(33)29-19-8-4-7-17(25)11-19/h2-12H,13-14H2,1H3,(H2,28,29,33)