1-[(5E)-5-[[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-oxidanylidene-1,3-thiazolidin-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-[(5E)-5-[[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-oxidanylidene-1,3-thiazolidin-2-yl]piperidine-4-carboxamide Openeye Name: 1-[(5E)-5-[[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-4-oxo-thiazolidin-2-yl]piperidine-4-carboxamide CAS Name: 1-[(5E)-5-[[3-(3-methyl-4-propoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-4-oxo-2-thiazolidinyl]-4-piperidinecarboxamide IUPAC Name: 1-[(5E)-5-[[3-(3-methyl-4-propoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-4-oxo-1,3-thiazolidin-2-yl]piperidine-4-carboxamide Traditional Name: 1-[(5E)-4-keto-5-[[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]thiazolidin-2-yl]isonipecotamide Formula: C29H33N5O3S MolecularWeight: 531.66902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C/3\C(=O)NC(S3)N4CCC(CC4)C(=O)N)C5=CC=CC=C5)C

InChI

InChI=1S/C29H33N5O3S/c1-3-15-37-24-10-9-21(16-19(24)2)26-22(18-34(32-26)23-7-5-4-6-8-23)17-25-28(36)31-29(38-25)33-13-11-20(12-14-33)27(30)35/h4-10,16-18,20,29H,3,11-15H2,1-2H3,(H2,30,35)(H,31,36)/b25-17+