N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]quinolin-2-amine

Systemtic Name: N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]quinolin-2-amine Openeye Name: N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]quinolin-2-amine CAS Name: N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-quinolinamine IUPAC Name: N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]quinolin-2-amine Traditional Name: [(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-(2-quinolyl)amine Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=NNC3=NC4=CC=CC=C4C=C3)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=N/NC3=NC4=CC=CC=C4C=C3)C5=CC=CC=C5)OC

InChI

InChI=1S/C27H23N5O2/c1-33-24-14-12-20(16-25(24)34-2)27-21(18-32(31-27)22-9-4-3-5-10-22)17-28-30-26-15-13-19-8-6-7-11-23(19)29-26/h3-18H,1-2H3,(H,29,30)/b28-17+