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

Systemtic Name: 4-[2-[(3-chlorophenyl)-(methoxymethyl)amino]pyrimidin-4-yl]-1,5-dimethyl-2-pyridin-2-yl-pyrazol-3-one Openeye Name: 4-[2-[3-chloro-N-(methoxymethyl)anilino]pyrimidin-4-yl]-1,5-dimethyl-2-(2-pyridyl)pyrazol-3-one CAS Name: 4-[2-[3-chloro-N-(methoxymethyl)anilino]-4-pyrimidinyl]-1,5-dimethyl-2-(2-pyridinyl)-3-pyrazolone IUPAC Name: 4-[2-[3-chloro-N-(methoxymethyl)anilino]pyrimidin-4-yl]-1,5-dimethyl-2-pyridin-2-ylpyrazol-3-one Traditional Name: 4-[2-[3-chloro-N-(methoxymethyl)anilino]pyrimidin-4-yl]-1,5-dimethyl-2-(2-pyridyl)-3-pyrazolin-3-one Formula: C22H21ClN6O2 MolecularWeight: 436.89414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=N2)C3=NC(=NC=C3)N(COC)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=N2)C3=NC(=NC=C3)N(COC)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C22H21ClN6O2/c1-15-20(21(30)29(27(15)2)19-9-4-5-11-24-19)18-10-12-25-22(26-18)28(14-31-3)17-8-6-7-16(23)13-17/h4-13H,14H2,1-3H3