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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidin-1-yl]-N-methyl-ethanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidin-1-yl]-N-methyl-ethanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-1-pyrrolidinyl]-N-methylethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[2-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)pyrrolidin-1-yl]-N-methylethanamine Traditional Name: 2-[2-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)pyrrolidino]ethyl-methyl-piperonyl-amine Formula: C23H28N6O2 MolecularWeight: 420.50742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2CCCN2CCN(C)CC3=CC4=C(C=C3)OCO4)N5C=CN=C5

Isomeric SMILES

CC1=NC(=NC(=C1)C2CCCN2CCN(C)CC3=CC4=C(C=C3)OCO4)N5C=CN=C5

InChI

InChI=1S/C23H28N6O2/c1-17-12-19(26-23(25-17)29-9-7-24-15-29)20-4-3-8-28(20)11-10-27(2)14-18-5-6-21-22(13-18)31-16-30-21/h5-7,9,12-13,15,20H,3-4,8,10-11,14,16H2,1-2H3