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

Systemtic Name: 1-[[4-(5-chloranyl-2-methyl-phenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-(3-methylphenyl)urea Openeye Name: 1-[[4-(5-chloro-2-methyl-phenyl)-5-(o-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-3-(m-tolyl)urea CAS Name: 1-[[4-(5-chloro-2-methylphenyl)-5-[(2-methylphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]-3-(3-methylphenyl)urea IUPAC Name: 1-[[4-(5-chloro-2-methylphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-(3-methylphenyl)urea Traditional Name: 1-[[4-(5-chloro-2-methyl-phenyl)-5-[(2-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-3-(m-tolyl)urea Formula: C26H26ClN5OS MolecularWeight: 492.03554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)C)SCC4=CC=CC=C4C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)C)SCC4=CC=CC=C4C

InChI

InChI=1S/C26H26ClN5OS/c1-17-7-6-10-22(13-17)29-25(33)28-15-24-30-31-26(34-16-20-9-5-4-8-18(20)2)32(24)23-14-21(27)12-11-19(23)3/h4-14H,15-16H2,1-3H3,(H2,28,29,33)