1-[3-azanyl-5-(3,4-dimethoxyphenyl)pyrazol-1-yl]-2-[3-(phenylcarbonyl)phenyl]propan-1-one

Systemtic Name: 1-[3-azanyl-5-(3,4-dimethoxyphenyl)pyrazol-1-yl]-2-[3-(phenylcarbonyl)phenyl]propan-1-one Openeye Name: 1-[3-amino-5-(3,4-dimethoxyphenyl)pyrazol-1-yl]-2-(3-benzoylphenyl)propan-1-one CAS Name: 1-[3-amino-5-(3,4-dimethoxyphenyl)-1-pyrazolyl]-2-(3-benzoylphenyl)-1-propanone IUPAC Name: 1-[3-amino-5-(3,4-dimethoxyphenyl)pyrazol-1-yl]-2-(3-benzoylphenyl)propan-1-one Traditional Name: 1-[3-amino-5-(3,4-dimethoxyphenyl)pyrazol-1-yl]-2-(3-benzoylphenyl)propan-1-one Formula: C27H25N3O4 MolecularWeight: 455.5051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)N3C(=CC(=N3)N)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)N3C(=CC(=N3)N)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H25N3O4/c1-17(19-10-7-11-21(14-19)26(31)18-8-5-4-6-9-18)27(32)30-22(16-25(28)29-30)20-12-13-23(33-2)24(15-20)34-3/h4-17H,1-3H3,(H2,28,29)