(4Z)-5-methyl-4-[[5-(4-oxidanylpiperidin-1-yl)thiophen-2-yl]methylidene]-2-phenyl-pyrazol-3-one

Systemtic Name: (4Z)-5-methyl-4-[[5-(4-oxidanylpiperidin-1-yl)thiophen-2-yl]methylidene]-2-phenyl-pyrazol-3-one Openeye Name: (4Z)-4-[[5-(4-hydroxy-1-piperidyl)-2-thienyl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4Z)-4-[[5-(4-hydroxy-1-piperidinyl)-2-thiophenyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4Z)-4-[[5-(4-hydroxypiperidin-1-yl)thiophen-2-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4Z)-4-[[5-(4-hydroxypiperidino)-2-thienyl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(S2)N3CCC(CC3)O)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(S2)N3CCC(CC3)O)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O2S/c1-14-18(20(25)23(21-14)15-5-3-2-4-6-15)13-17-7-8-19(26-17)22-11-9-16(24)10-12-22/h2-8,13,16,24H,9-12H2,1H3/b18-13-