4-bromanyl-1-[(4-chlorophenyl)methyl]-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-[(4-chlorophenyl)methyl]-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]pyrazole-3-carboxamide Openeye Name: N-[(E)-(2-benzyloxyphenyl)methyleneamino]-4-bromo-1-[(4-chlorophenyl)methyl]pyrazole-3-carboxamide CAS Name: 4-bromo-1-[(4-chlorophenyl)methyl]-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-[(4-chlorophenyl)methyl]-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]pyrazole-3-carboxamide Traditional Name: N-[(E)-(2-benzoxybenzylidene)amino]-4-bromo-1-(4-chlorobenzyl)pyrazole-3-carboxamide Formula: C25H20BrClN4O2 MolecularWeight: 523.8089

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC=C2C=NNC(=O)C3=NN(C=C3Br)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC=C2/C=N/NC(=O)C3=NN(C=C3Br)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20BrClN4O2/c26-22-16-31(15-18-10-12-21(27)13-11-18)30-24(22)25(32)29-28-14-20-8-4-5-9-23(20)33-17-19-6-2-1-3-7-19/h1-14,16H,15,17H2,(H,29,32)/b28-14+