1-[(4-chlorophenyl)methyl]-N-[(E)-quinolin-8-ylmethylideneamino]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-quinolin-8-ylmethylideneamino]pyrazole-3-carboxamide Openeye Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-8-quinolylmethyleneamino]pyrazole-3-carboxamide CAS Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-8-quinolinylmethylideneamino]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chlorophenyl)methyl]-N-[(E)-quinolin-8-ylmethylideneamino]pyrazole-3-carboxamide Traditional Name: 1-(4-chlorobenzyl)-N-[(E)-8-quinolylmethyleneamino]pyrazole-3-carboxamide Formula: C21H16ClN5O MolecularWeight: 389.83764

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)C=NNC(=O)C3=NN(C=C3)CC4=CC=C(C=C4)Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)/C=N/NC(=O)C3=NN(C=C3)CC4=CC=C(C=C4)Cl)N=CC=C2

InChI

InChI=1S/C21H16ClN5O/c22-18-8-6-15(7-9-18)14-27-12-10-19(26-27)21(28)25-24-13-17-4-1-3-16-5-2-11-23-20(16)17/h1-13H,14H2,(H,25,28)/b24-13+