2-(4-bromanylphenoxy)-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]ethanamide Openeye Name: N-[(E)-[3-(4-benzyloxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-(4-bromophenoxy)acetamide CAS Name: 2-(4-bromophenoxy)-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)-4-pyrazolyl]methylideneamino]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]acetamide Traditional Name: N-[(E)-[3-(4-benzoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-(4-bromophenoxy)acetamide Formula: C31H25BrN4O3 MolecularWeight: 581.4592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C=C3C=NNC(=O)COC4=CC=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C=C3/C=N/NC(=O)COC4=CC=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C31H25BrN4O3/c32-26-13-17-29(18-14-26)39-22-30(37)34-33-19-25-20-36(27-9-5-2-6-10-27)35-31(25)24-11-15-28(16-12-24)38-21-23-7-3-1-4-8-23/h1-20H,21-22H2,(H,34,37)/b33-19+