(4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(4-morpholin-4-ylphenyl)methylidene]pyrazol-3-one

Systemtic Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(4-morpholin-4-ylphenyl)methylidene]pyrazol-3-one Openeye Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(4-morpholinophenyl)methylene]pyrazol-3-one CAS Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[[4-(4-morpholinyl)phenyl]methylidene]-3-pyrazolone IUPAC Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-[(4-morpholin-4-ylphenyl)methylidene]pyrazol-3-one Traditional Name: (4Z)-2-(1,3-benzothiazol-2-yl)-5-methyl-4-(4-morpholinobenzylidene)-2-pyrazolin-3-one Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)N3CCOCC3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C2=CC=C(C=C2)N3CCOCC3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H20N4O2S/c1-15-18(14-16-6-8-17(9-7-16)25-10-12-28-13-11-25)21(27)26(24-15)22-23-19-4-2-3-5-20(19)29-22/h2-9,14H,10-13H2,1H3/b18-14-