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

Systemtic Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]ethanamide Openeye Name: 2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide CAS Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide IUPAC Name: 2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide Traditional Name: 2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(2,4,5-trimethoxybenzyl)acetamide Formula: C18H20N4O4S2 MolecularWeight: 420.5058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)CN2C(=NNC2=S)C3=CC=CS3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)CN2C(=NNC2=S)C3=CC=CS3)OC)OC

InChI

InChI=1S/C18H20N4O4S2/c1-24-12-8-14(26-3)13(25-2)7-11(12)9-19-16(23)10-22-17(20-21-18(22)27)15-5-4-6-28-15/h4-8H,9-10H2,1-3H3,(H,19,23)(H,21,27)