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

Systemtic Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(2,4-dimethylphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,4-dimethylbenzyl)-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN(C)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN(C)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3)C

InChI

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