3-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(E)-quinolin-8-ylmethylideneamino]benzamide

Systemtic Name: 3-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(E)-quinolin-8-ylmethylideneamino]benzamide Openeye Name: 3-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(E)-8-quinolylmethyleneamino]benzamide CAS Name: 3-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-N-[(E)-8-quinolinylmethylideneamino]benzamide IUPAC Name: 3-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]-N-[(E)-quinolin-8-ylmethylideneamino]benzamide Traditional Name: 3-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[(E)-8-quinolylmethyleneamino]benzamide Formula: C23H20ClN5O MolecularWeight: 417.8908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NN=CC3=CC=CC4=C3N=CC=C4)C)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)N/N=C/C3=CC=CC4=C3N=CC=C4)C)Cl

InChI

InChI=1S/C23H20ClN5O/c1-15-21(24)16(2)29(28-15)14-17-6-3-8-19(12-17)23(30)27-26-13-20-9-4-7-18-10-5-11-25-22(18)20/h3-13H,14H2,1-2H3,(H,27,30)/b26-13+