(4E)-4-[[(2-ethoxyphenyl)amino]methylidene]-5-methyl-2-(4-piperidin-1-ylsulfonylphenyl)pyrazol-3-one

Systemtic Name: (4E)-4-[[(2-ethoxyphenyl)amino]methylidene]-5-methyl-2-(4-piperidin-1-ylsulfonylphenyl)pyrazol-3-one Openeye Name: (4E)-4-[(2-ethoxyanilino)methylene]-5-methyl-2-[4-(1-piperidylsulfonyl)phenyl]pyrazol-3-one CAS Name: (4E)-4-[(2-ethoxyanilino)methylidene]-5-methyl-2-[4-(1-piperidinylsulfonyl)phenyl]-3-pyrazolone IUPAC Name: (4E)-4-[(2-ethoxyanilino)methylidene]-5-methyl-2-(4-piperidin-1-ylsulfonylphenyl)pyrazol-3-one Traditional Name: (4E)-5-methyl-4-(o-phenetidinomethylene)-2-(4-piperidinosulfonylphenyl)-2-pyrazolin-3-one Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC=C2C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CCOC1=CC=CC=C1N/C=C/2\C(=NN(C2=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C24H28N4O4S/c1-3-32-23-10-6-5-9-22(23)25-17-21-18(2)26-28(24(21)29)19-11-13-20(14-12-19)33(30,31)27-15-7-4-8-16-27/h5-6,9-14,17,25H,3-4,7-8,15-16H2,1-2H3/b21-17+