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

Systemtic Name: N-[(3-fluoranyl-4-methoxy-phenyl)methyl]-N-methyl-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[(3-fluoro-4-methoxy-phenyl)methyl]-N-methyl-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide CAS Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methyl-2-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-(3-fluoro-4-methoxy-benzyl)-N-methyl-2-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetamide Formula: C17H17FN4O2S2 MolecularWeight: 392.470883

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OC)F)C(=O)CN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OC)F)C(=O)CN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C17H17FN4O2S2/c1-21(9-11-5-6-13(24-2)12(18)8-11)15(23)10-22-16(19-20-17(22)25)14-4-3-7-26-14/h3-8H,9-10H2,1-2H3,(H,20,25)