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

Systemtic Name: N-[1-[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Openeye Name: N-[1-[4-ethyl-5-(p-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide CAS Name: N-[1-[4-ethyl-5-[(4-methylphenyl)methylthio]-1,2,4-triazol-3-yl]-2-methylpropyl]benzamide IUPAC Name: N-[1-[4-ethyl-5-[(4-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]-2-methylpropyl]benzamide Traditional Name: N-[1-[4-ethyl-5-[(4-methylbenzyl)thio]-1,2,4-triazol-3-yl]-2-methyl-propyl]benzamide Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4OS/c1-5-27-21(20(16(2)3)24-22(28)19-9-7-6-8-10-19)25-26-23(27)29-15-18-13-11-17(4)12-14-18/h6-14,16,20H,5,15H2,1-4H3,(H,24,28)