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

Systemtic Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-(ethylthio)-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: 4-tert-butyl-N-[[4-(3,4-dichlorophenyl)-5-(ethylthio)-1,2,4-triazol-3-yl]methyl]benzamide Formula: C22H24Cl2N4OS MolecularWeight: 463.42316

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)CNC(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCSC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)CNC(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H24Cl2N4OS/c1-5-30-21-27-26-19(28(21)16-10-11-17(23)18(24)12-16)13-25-20(29)14-6-8-15(9-7-14)22(2,3)4/h6-12H,5,13H2,1-4H3,(H,25,29)