(4E)-2-(4-ethanoylphenyl)-5-methyl-4-(thiophen-2-ylmethylidene)pyrazol-3-one

Systemtic Name: (4E)-2-(4-ethanoylphenyl)-5-methyl-4-(thiophen-2-ylmethylidene)pyrazol-3-one Openeye Name: (4E)-2-(4-acetylphenyl)-5-methyl-4-(2-thienylmethylene)pyrazol-3-one CAS Name: (4E)-2-(4-acetylphenyl)-5-methyl-4-(thiophen-2-ylmethylidene)-3-pyrazolone IUPAC Name: (4E)-2-(4-acetylphenyl)-5-methyl-4-(thiophen-2-ylmethylidene)pyrazol-3-one Traditional Name: (4E)-2-(4-acetylphenyl)-5-methyl-4-(2-thenylidene)-2-pyrazolin-3-one Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=CS2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=CS2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C17H14N2O2S/c1-11-16(10-15-4-3-9-22-15)17(21)19(18-11)14-7-5-13(6-8-14)12(2)20/h3-10H,1-2H3/b16-10+