2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(3,4,5-trimethoxyphenyl)ethanamide

Systemtic Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(3,4,5-trimethoxyphenyl)ethanamide Openeye Name: 2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(3,4,5-trimethoxyphenyl)acetamide CAS Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(3,4,5-trimethoxyphenyl)acetamide IUPAC Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-(3,4,5-trimethoxyphenyl)acetamide Traditional Name: 2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(3,4,5-trimethoxyphenyl)acetamide Formula: C17H18N4O4S2 MolecularWeight: 406.47922

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C17H18N4O4S2/c1-23-11-7-10(8-12(24-2)15(11)25-3)18-14(22)9-21-16(19-20-17(21)26)13-5-4-6-27-13/h4-8H,9H2,1-3H3,(H,18,22)(H,20,26)