2-(3-imidazol-1-ylpropylamino)-N-(2-methylpropyl)-4-(2-methylpropylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-(3-imidazol-1-ylpropylamino)-N-(2-methylpropyl)-4-(2-methylpropylamino)pyrimidine-5-carboxamide Openeye Name: 2-(3-imidazol-1-ylpropylamino)-N-isobutyl-4-(isobutylamino)pyrimidine-5-carboxamide CAS Name: 2-[3-(1-imidazolyl)propylamino]-N-(2-methylpropyl)-4-(2-methylpropylamino)-5-pyrimidinecarboxamide IUPAC Name: 2-(3-imidazol-1-ylpropylamino)-N-(2-methylpropyl)-4-(2-methylpropylamino)pyrimidine-5-carboxamide Traditional Name: 2-(3-imidazol-1-ylpropylamino)-N-isobutyl-4-(isobutylamino)pyrimidine-5-carboxamide Formula: C19H31N7O MolecularWeight: 373.49574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC=C1C(=O)NCC(C)C)NCCCN2C=CN=C2

Isomeric SMILES

CC(C)CNC1=NC(=NC=C1C(=O)NCC(C)C)NCCCN2C=CN=C2

InChI

InChI=1S/C19H31N7O/c1-14(2)10-22-17-16(18(27)23-11-15(3)4)12-24-19(25-17)21-6-5-8-26-9-7-20-13-26/h7,9,12-15H,5-6,8,10-11H2,1-4H3,(H,23,27)(H2,21,22,24,25)