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

Systemtic Name: N-(2-methylpropyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-isobutyl-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(2-methylpropyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(2-methylpropyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-isobutyl-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C13H18N4OS2 MolecularWeight: 310.43822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2

Isomeric SMILES

CC(C)CNC(=O)CCN1C(=NNC1=S)C2=CC=CS2

InChI

InChI=1S/C13H18N4OS2/c1-9(2)8-14-11(18)5-6-17-12(15-16-13(17)19)10-4-3-7-20-10/h3-4,7,9H,5-6,8H2,1-2H3,(H,14,18)(H,16,19)