N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide

Systemtic Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]-4-(2-thienyl)butyramide Formula: C17H16N4O2S MolecularWeight: 340.39954

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1C2=CC(=CC=C2)NC(=O)CCC(=O)C3=CC=CS3

Isomeric SMILES

CN1C=NN=C1C2=CC(=CC=C2)NC(=O)CCC(=O)C3=CC=CS3

InChI

InChI=1S/C17H16N4O2S/c1-21-11-18-20-17(21)12-4-2-5-13(10-12)19-16(23)8-7-14(22)15-6-3-9-24-15/h2-6,9-11H,7-8H2,1H3,(H,19,23)