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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=NC=C2)CN3C=CN=C3)CC(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CC(N(C1)C2=NC(=NC=C2)CN3C=CN=C3)CC(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H24N6O3/c29-22(25-12-16-3-4-18-19(10-16)31-15-30-18)11-17-2-1-8-28(17)21-5-6-24-20(26-21)13-27-9-7-23-14-27/h3-7,9-10,14,17H,1-2,8,11-13,15H2,(H,25,29)