5-azanyl-4-(2-methylpropylamino)-6-(3-oxidanylazetidin-1-yl)pyrimidine-2-carbonitrile

Systemtic Name: 5-azanyl-4-(2-methylpropylamino)-6-(3-oxidanylazetidin-1-yl)pyrimidine-2-carbonitrile Openeye Name: 5-amino-4-(3-hydroxyazetidin-1-yl)-6-(isobutylamino)pyrimidine-2-carbonitrile CAS Name: 5-amino-4-(3-hydroxy-1-azetidinyl)-6-(2-methylpropylamino)-2-pyrimidinecarbonitrile IUPAC Name: 5-amino-4-(3-hydroxyazetidin-1-yl)-6-(2-methylpropylamino)pyrimidine-2-carbonitrile Traditional Name: 5-amino-4-(3-hydroxyazetidin-1-yl)-6-(isobutylamino)pyrimidine-2-carbonitrile Formula: C12H18N6O MolecularWeight: 262.31092

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC(=C1N)N2CC(C2)O)C#N

Isomeric SMILES

CC(C)CNC1=NC(=NC(=C1N)N2CC(C2)O)C#N

InChI

InChI=1S/C12H18N6O/c1-7(2)4-15-11-10(14)12(17-9(3-13)16-11)18-5-8(19)6-18/h7-8,19H,4-6,14H2,1-2H3,(H,15,16,17)