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

Systemtic Name: N-[[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]benzamide Openeye Name: N-[[4-ethyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]benzamide CAS Name: N-[[4-ethyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: N-[[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]benzamide Traditional Name: N-[[4-ethyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]benzamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=C(C=C2)C)CNC(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=C(C=C2)C)CNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4OS/c1-3-24-18(13-21-19(25)17-7-5-4-6-8-17)22-23-20(24)26-14-16-11-9-15(2)10-12-16/h4-12H,3,13-14H2,1-2H3,(H,21,25)