N-[(E)-(2-chlorophenyl)methylideneamino]-4-(3,4-dimethoxyphenyl)-6-phenyl-pyrimidin-2-amine

Systemtic Name: N-[(E)-(2-chlorophenyl)methylideneamino]-4-(3,4-dimethoxyphenyl)-6-phenyl-pyrimidin-2-amine Openeye Name: N-[(E)-(2-chlorophenyl)methyleneamino]-4-(3,4-dimethoxyphenyl)-6-phenyl-pyrimidin-2-amine CAS Name: N-[(E)-(2-chlorophenyl)methylideneamino]-4-(3,4-dimethoxyphenyl)-6-phenyl-2-pyrimidinamine IUPAC Name: N-[(E)-(2-chlorophenyl)methylideneamino]-4-(3,4-dimethoxyphenyl)-6-phenylpyrimidin-2-amine Traditional Name: [(E)-(2-chlorobenzylidene)amino]-[4-(3,4-dimethoxyphenyl)-6-phenyl-pyrimidin-2-yl]amine Formula: C25H21ClN4O2 MolecularWeight: 444.91284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC(=C2)C3=CC=CC=C3)NN=CC4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC(=C2)C3=CC=CC=C3)N/N=C/C4=CC=CC=C4Cl)OC

InChI

InChI=1S/C25H21ClN4O2/c1-31-23-13-12-18(14-24(23)32-2)22-15-21(17-8-4-3-5-9-17)28-25(29-22)30-27-16-19-10-6-7-11-20(19)26/h3-16H,1-2H3,(H,28,29,30)/b27-16+