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

Systemtic Name: 1-[[4-[2,5-bis(chloranyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-phenyl-urea Openeye Name: 1-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-phenyl-urea CAS Name: 1-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylthio]-1,2,4-triazol-3-yl]methyl]-3-phenylurea IUPAC Name: 1-[[4-(2,5-dichlorophenyl)-5-[(4-fluorophenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-3-phenylurea Traditional Name: 1-[[4-(2,5-dichlorophenyl)-5-[(4-fluorobenzyl)thio]-1,2,4-triazol-3-yl]methyl]-3-phenyl-urea Formula: C23H18Cl2FN5OS MolecularWeight: 502.391323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)SCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C23H18Cl2FN5OS/c24-16-8-11-19(25)20(12-16)31-21(13-27-22(32)28-18-4-2-1-3-5-18)29-30-23(31)33-14-15-6-9-17(26)10-7-15/h1-12H,13-14H2,(H2,27,28,32)