2-(4-methylpiperidin-1-yl)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-(4-methylpiperidin-1-yl)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one Openeye Name: 2-(4-methyl-1-piperidyl)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylene]thiazol-4-one CAS Name: 2-(4-methyl-1-piperidinyl)-5-[[1-phenyl-3-(3-propoxyphenyl)-4-pyrazolyl]methylidene]-4-thiazolone IUPAC Name: 2-(4-methylpiperidin-1-yl)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylidene]-1,3-thiazol-4-one Traditional Name: 2-(4-methylpiperidino)-5-[[1-phenyl-3-(3-propoxyphenyl)pyrazol-4-yl]methylene]-2-thiazolin-4-one Formula: C28H30N4O2S MolecularWeight: 486.6284

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)C)C5=CC=CC=C5

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)C)C5=CC=CC=C5

InChI

InChI=1S/C28H30N4O2S/c1-3-16-34-24-11-7-8-21(17-24)26-22(19-32(30-26)23-9-5-4-6-10-23)18-25-27(33)29-28(35-25)31-14-12-20(2)13-15-31/h4-11,17-20H,3,12-16H2,1-2H3