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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-methyl-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]-N-veratryl-acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O3S/c1-24(12-14-9-10-16(26-2)17(11-14)27-3)18(25)13-28-20-21-19(22-23-20)15-7-5-4-6-8-15/h4-11H,12-13H2,1-3H3,(H,21,22,23)