N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N'-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N'-methyl-propane-1,3-diamine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N'-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N'-methyl-propane-1,3-diamine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N'-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N'-methyl-propane-1,3-diamine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N'-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-N'-methylpropane-1,3-diamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N'-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-N'-methylpropane-1,3-diamine Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-methyl-amine Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N(C)CCCNCC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N(C)CCCNCC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H26N6O2/c1-16-12-20(25-21(24-16)27-9-7-23-15-27)26(2)8-3-6-22-14-17-4-5-18-19(13-17)29-11-10-28-18/h4-5,7,9,12-13,15,22H,3,6,8,10-11,14H2,1-2H3