N-[3-(2-fluoranylphenoxy)propyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-[3-(2-fluoranylphenoxy)propyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-[3-(2-fluorophenoxy)propyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-[3-(2-fluorophenoxy)propyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-[3-(2-fluorophenoxy)propyl]-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-[3-(2-fluorophenoxy)propyl]-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C18H19FN4O2S2 MolecularWeight: 406.497463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCCNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCCNC(=O)CCN2C(=NNC2=S)C3=CC=CS3)F

InChI

InChI=1S/C18H19FN4O2S2/c19-13-5-1-2-6-14(13)25-11-4-9-20-16(24)8-10-23-17(21-22-18(23)26)15-7-3-12-27-15/h1-3,5-7,12H,4,8-11H2,(H,20,24)(H,22,26)