N-[(3,5-dimethoxyphenyl)methyl]-N'-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N'-methyl-propane-1,3-diamine

Systemtic Name: N-[(3,5-dimethoxyphenyl)methyl]-N'-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N'-methyl-propane-1,3-diamine Openeye Name: N-[(3,5-dimethoxyphenyl)methyl]-N'-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-N'-methyl-propane-1,3-diamine CAS Name: N-[(3,5-dimethoxyphenyl)methyl]-N'-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-N'-methylpropane-1,3-diamine IUPAC Name: N-[(3,5-dimethoxyphenyl)methyl]-N'-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)-N'-methylpropane-1,3-diamine Traditional Name: 3-[(3,5-dimethoxybenzyl)amino]propyl-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-methyl-amine Formula: C21H28N6O2 MolecularWeight: 396.48602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N6O2/c1-16-10-20(25-21(24-16)27-9-7-23-15-27)26(2)8-5-6-22-14-17-11-18(28-3)13-19(12-17)29-4/h7,9-13,15,22H,5-6,8,14H2,1-4H3