N-[(E)-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(E)-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]-2-phenyl-cinchoninamide Formula: C30H26BrN5O2 MolecularWeight: 568.46374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)OC)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)/C=N/NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5)OC)C)Br

InChI

InChI=1S/C30H26BrN5O2/c1-19-29(31)20(2)36(35-19)18-23-15-21(13-14-28(23)38-3)17-32-34-30(37)25-16-27(22-9-5-4-6-10-22)33-26-12-8-7-11-24(25)26/h4-17H,18H2,1-3H3,(H,34,37)/b32-17+