N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)pyrrolidin-2-yl]ethanamide

Systemtic Name: N-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)pyrrolidin-2-yl]ethanamide Openeye Name: N-[(3-chloro-4-methoxy-phenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)pyrrolidin-2-yl]acetamide CAS Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-[1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-pyrrolidinyl]acetamide IUPAC Name: N-[(3-chloro-4-methoxyphenyl)methyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)pyrrolidin-2-yl]acetamide Traditional Name: N-(3-chloro-4-methoxy-benzyl)-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)pyrrolidin-2-yl]acetamide Formula: C21H23ClN6O2 MolecularWeight: 426.89932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CC2CCCN2C3=NC(=NC=C3)N4C=CN=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CC2CCCN2C3=NC(=NC=C3)N4C=CN=C4)Cl

InChI

InChI=1S/C21H23ClN6O2/c1-30-18-5-4-15(11-17(18)22)13-25-20(29)12-16-3-2-9-28(16)19-6-7-24-21(26-19)27-10-8-23-14-27/h4-8,10-11,14,16H,2-3,9,12-13H2,1H3,(H,25,29)