(4E)-4-[(5-methylthiophen-2-yl)methylidene]-2-phenyl-5-propyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(5-methylthiophen-2-yl)methylidene]-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: (4E)-4-[(5-methyl-2-thienyl)methylene]-2-phenyl-5-propyl-pyrazol-3-one CAS Name: (4E)-4-[(5-methyl-2-thiophenyl)methylidene]-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: (4E)-4-[(5-methylthiophen-2-yl)methylidene]-2-phenyl-5-propylpyrazol-3-one Traditional Name: (4E)-4-[(5-methyl-2-thienyl)methylene]-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=CC2=CC=C(S2)C)C3=CC=CC=C3

Isomeric SMILES

CCCC\1=NN(C(=O)/C1=C/C2=CC=C(S2)C)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2OS/c1-3-7-17-16(12-15-11-10-13(2)22-15)18(21)20(19-17)14-8-5-4-6-9-14/h4-6,8-12H,3,7H2,1-2H3/b16-12+