2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SCC(=O)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C21H24N4O4S/c1-5-18-23-24-21(25(18)15-9-7-6-8-10-15)30-13-19(26)22-14-11-16(27-2)20(29-4)17(12-14)28-3/h6-12H,5,13H2,1-4H3,(H,22,26)