4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-propylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-(propylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C23H26Cl2N4OS MolecularWeight: 477.44974

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)CNC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)CNC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H26Cl2N4OS/c1-5-12-31-22-28-27-20(29(22)17-10-11-18(24)19(25)13-17)14-26-21(30)15-6-8-16(9-7-15)23(2,3)4/h6-11,13H,5,12,14H2,1-4H3,(H,26,30)