N-[(4-dimethylaminophenyl)methyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[4-(dimethylamino)benzyl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)CSC2=NNC(=N2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CSC2=NNC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C19H21N5OS/c1-24(2)16-10-8-14(9-11-16)12-20-17(25)13-26-19-21-18(22-23-19)15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3,(H,20,25)(H,21,22,23)