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

Systemtic Name: N-[[4-[2,5-bis(chloranyl)phenyl]-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-4-methyl-benzamide Openeye Name: N-[[4-(2,5-dichlorophenyl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-4-methyl-benzamide CAS Name: N-[[4-(2,5-dichlorophenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide IUPAC Name: N-[[4-(2,5-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-4-methylbenzamide Traditional Name: N-[[4-(2,5-dichlorophenyl)-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-4-methyl-benzamide Formula: C25H22Cl2N4OS MolecularWeight: 497.43938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)SCC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)SCC4=CC=CC(=C4)C

InChI

InChI=1S/C25H22Cl2N4OS/c1-16-6-8-19(9-7-16)24(32)28-14-23-29-30-25(33-15-18-5-3-4-17(2)12-18)31(23)22-13-20(26)10-11-21(22)27/h3-13H,14-15H2,1-2H3,(H,28,32)