4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(3-imidazol-1-ylpropylamino)-N-(2-methylpropyl)pyrimidine-5-carboxamide

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(3-imidazol-1-ylpropylamino)-N-(2-methylpropyl)pyrimidine-5-carboxamide Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(3-imidazol-1-ylpropylamino)-N-isobutyl-pyrimidine-5-carboxamide CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-[3-(1-imidazolyl)propylamino]-N-(2-methylpropyl)-5-pyrimidinecarboxamide IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethylamino]-2-(3-imidazol-1-ylpropylamino)-N-(2-methylpropyl)pyrimidine-5-carboxamide Traditional Name: 4-(homoveratrylamino)-2-(3-imidazol-1-ylpropylamino)-N-isobutyl-pyrimidine-5-carboxamide Formula: C25H35N7O3 MolecularWeight: 481.5905

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN=C(N=C1NCCC2=CC(=C(C=C2)OC)OC)NCCCN3C=CN=C3

Isomeric SMILES

CC(C)CNC(=O)C1=CN=C(N=C1NCCC2=CC(=C(C=C2)OC)OC)NCCCN3C=CN=C3

InChI

InChI=1S/C25H35N7O3/c1-18(2)15-29-24(33)20-16-30-25(28-9-5-12-32-13-11-26-17-32)31-23(20)27-10-8-19-6-7-21(34-3)22(14-19)35-4/h6-7,11,13-14,16-18H,5,8-10,12,15H2,1-4H3,(H,29,33)(H2,27,28,30,31)