(4Z)-2-(4-bromophenyl)-4-[[4-(diethylamino)phenyl]methylidene]-5-methyl-pyrazol-3-one

Systemtic Name: (4Z)-2-(4-bromophenyl)-4-[[4-(diethylamino)phenyl]methylidene]-5-methyl-pyrazol-3-one Openeye Name: (4Z)-2-(4-bromophenyl)-4-[[4-(diethylamino)phenyl]methylene]-5-methyl-pyrazol-3-one CAS Name: (4Z)-2-(4-bromophenyl)-4-[[4-(diethylamino)phenyl]methylidene]-5-methyl-3-pyrazolone IUPAC Name: (4Z)-2-(4-bromophenyl)-4-[[4-(diethylamino)phenyl]methylidene]-5-methylpyrazol-3-one Traditional Name: (4Z)-2-(4-bromophenyl)-4-[4-(diethylamino)benzylidene]-5-methyl-2-pyrazolin-3-one Formula: C21H22BrN3O MolecularWeight: 412.32288

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=C2C(=NN(C2=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=C\2/C(=NN(C2=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C21H22BrN3O/c1-4-24(5-2)18-10-6-16(7-11-18)14-20-15(3)23-25(21(20)26)19-12-8-17(22)9-13-19/h6-14H,4-5H2,1-3H3/b20-14-