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

Systemtic Name: N-(4-ethanoylphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Openeye Name: N-(4-acetylphenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propanamide CAS Name: N-(4-acetylphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide IUPAC Name: N-(4-acetylphenyl)-3-(5-sulfanylidene-3-thiophen-2-yl-1H-1,2,4-triazol-4-yl)propanamide Traditional Name: N-(4-acetylphenyl)-3-[3-(2-thienyl)-5-thioxo-1H-1,2,4-triazol-4-yl]propionamide Formula: C17H16N4O2S2 MolecularWeight: 372.46454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N4O2S2/c1-11(22)12-4-6-13(7-5-12)18-15(23)8-9-21-16(19-20-17(21)24)14-3-2-10-25-14/h2-7,10H,8-9H2,1H3,(H,18,23)(H,20,24)