1,5-dimethyl-4-[(E)-3-oxidanylidene-3-thiophen-2-yl-prop-1-enyl]-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-[(E)-3-oxidanylidene-3-thiophen-2-yl-prop-1-enyl]-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-[(E)-3-oxo-3-(2-thienyl)prop-1-enyl]-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-[(E)-3-oxo-3-thiophen-2-ylprop-1-enyl]-2-phenylpyrazol-3-one Traditional Name: 4-[(E)-3-keto-3-(2-thienyl)prop-1-enyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=CC(=O)C3=CC=CS3

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)/C=C/C(=O)C3=CC=CS3

InChI

InChI=1S/C18H16N2O2S/c1-13-15(10-11-16(21)17-9-6-12-23-17)18(22)20(19(13)2)14-7-4-3-5-8-14/h3-12H,1-2H3/b11-10+