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

Systemtic Name: N-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4,5-dimethoxy-2-methyl-phenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4,5-dimethoxy-2-methylphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4,5-dimethoxy-2-methyl-benzyl)-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN(C)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN(C)C(=O)CSC2=NNC(=N2)C3=CC=CC=C3)OC)OC

InChI

InChI=1S/C21H24N4O3S/c1-14-10-17(27-3)18(28-4)11-16(14)12-25(2)19(26)13-29-21-22-20(23-24-21)15-8-6-5-7-9-15/h5-11H,12-13H2,1-4H3,(H,22,23,24)