(5Z)-5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-2-morpholin-4-yl-1,3-thiazol-4-one

Systemtic Name: (5Z)-5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-2-morpholin-4-yl-1,3-thiazol-4-one Openeye Name: (5Z)-5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-morpholino-thiazol-4-one CAS Name: (5Z)-5-[[3-(3-butoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-2-(4-morpholinyl)-4-thiazolone IUPAC Name: (5Z)-5-[[3-(3-butoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2-morpholin-4-yl-1,3-thiazol-4-one Traditional Name: (5Z)-5-[[3-(3-butoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene]-2-morpholino-2-thiazolin-4-one Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2=NN(C=C2/C=C\3/C(=O)N=C(S3)N4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C27H28N4O3S/c1-2-3-14-34-23-11-7-8-20(17-23)25-21(19-31(29-25)22-9-5-4-6-10-22)18-24-26(32)28-27(35-24)30-12-15-33-16-13-30/h4-11,17-19H,2-3,12-16H2,1H3/b24-18-