N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidin-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-1-pyrrolidinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)pyrrolidin-1-yl]acetamide Traditional Name: 2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidino]-N-piperonyl-acetamide Formula: C22H24N6O3 MolecularWeight: 420.46436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2CCCN2CC(=O)NCC3=CC4=C(C=C3)OCO4)N5C=CN=C5

Isomeric SMILES

CC1=NC(=NC(=C1)C2CCCN2CC(=O)NCC3=CC4=C(C=C3)OCO4)N5C=CN=C5

InChI

InChI=1S/C22H24N6O3/c1-15-9-17(26-22(25-15)28-8-6-23-13-28)18-3-2-7-27(18)12-21(29)24-11-16-4-5-19-20(10-16)31-14-30-19/h4-6,8-10,13,18H,2-3,7,11-12,14H2,1H3,(H,24,29)