2-[4-[2-[(3-chlorophenyl)amino]pyridin-4-yl]pyridin-2-yl]-1-ethyl-4,5-dimethyl-pyrazol-3-one

Systemtic Name: 2-[4-[2-[(3-chlorophenyl)amino]pyridin-4-yl]pyridin-2-yl]-1-ethyl-4,5-dimethyl-pyrazol-3-one Openeye Name: 2-[4-[2-(3-chloroanilino)-4-pyridyl]-2-pyridyl]-1-ethyl-4,5-dimethyl-pyrazol-3-one CAS Name: 2-[4-[2-(3-chloroanilino)-4-pyridinyl]-2-pyridinyl]-1-ethyl-4,5-dimethyl-3-pyrazolone IUPAC Name: 2-[4-[2-(3-chloroanilino)pyridin-4-yl]pyridin-2-yl]-1-ethyl-4,5-dimethylpyrazol-3-one Traditional Name: 2-[4-[2-(3-chloroanilino)-4-pyridyl]-2-pyridyl]-1-ethyl-4,5-dimethyl-3-pyrazolin-3-one Formula: C23H22ClN5O MolecularWeight: 419.90668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N1C2=NC=CC(=C2)C3=CC(=NC=C3)NC4=CC(=CC=C4)Cl)C)C

Isomeric SMILES

CCN1C(=C(C(=O)N1C2=NC=CC(=C2)C3=CC(=NC=C3)NC4=CC(=CC=C4)Cl)C)C

InChI

InChI=1S/C23H22ClN5O/c1-4-28-16(3)15(2)23(30)29(28)22-13-18(9-11-26-22)17-8-10-25-21(12-17)27-20-7-5-6-19(24)14-20/h5-14H,4H2,1-3H3,(H,25,27)