N-cyclooctyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide

Systemtic Name: N-cyclooctyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-cyclooctyl-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-cyclooctyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-cyclooctyl-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-cyclooctyl-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H24N4OS2 MolecularWeight: 364.52866

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CCN2C(=NNC2=S)C3=CC=CS3

InChI

InChI=1S/C17H24N4OS2/c22-15(18-13-7-4-2-1-3-5-8-13)10-11-21-16(19-20-17(21)23)14-9-6-12-24-14/h6,9,12-13H,1-5,7-8,10-11H2,(H,18,22)(H,20,23)