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

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)ethanamine Openeye Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)ethanamine CAS Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]ethanamine IUPAC Name: N-[2-(1,3-benzodioxol-5-ylmethoxy)ethyl]-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)ethanamine Traditional Name: 1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)ethyl-(2-piperonyloxyethyl)amine Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)C(C)NCCOCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)C(C)NCCOCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H23N5O3/c1-14-9-17(24-20(23-14)25-7-5-21-12-25)15(2)22-6-8-26-11-16-3-4-18-19(10-16)28-13-27-18/h3-5,7,9-10,12,15,22H,6,8,11,13H2,1-2H3