2-[[(2R)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-[(3-pyrimidin-5-ylphenyl)amino]pyrimidine-5-carboxamide

Systemtic Name: 2-[[(2R)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-[(3-pyrimidin-5-ylphenyl)amino]pyrimidine-5-carboxamide Openeye Name: 2-[[(1R)-1-carbamoyl-3-methyl-butyl]amino]-4-(3-pyrimidin-5-ylanilino)pyrimidine-5-carboxamide CAS Name: 2-[[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-4-[3-(5-pyrimidinyl)anilino]-5-pyrimidinecarboxamide IUPAC Name: 2-[[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-4-(3-pyrimidin-5-ylanilino)pyrimidine-5-carboxamide Traditional Name: 2-[[(1R)-1-carbamoyl-3-methyl-butyl]amino]-4-[3-(5-pyrimidyl)anilino]pyrimidine-5-carboxamide Formula: C21H24N8O2 MolecularWeight: 420.46766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N)NC1=NC=C(C(=N1)NC2=CC=CC(=C2)C3=CN=CN=C3)C(=O)N

Isomeric SMILES

CC(C)C[C@H](C(=O)N)NC1=NC=C(C(=N1)NC2=CC=CC(=C2)C3=CN=CN=C3)C(=O)N

InChI

InChI=1S/C21H24N8O2/c1-12(2)6-17(19(23)31)28-21-26-10-16(18(22)30)20(29-21)27-15-5-3-4-13(7-15)14-8-24-11-25-9-14/h3-5,7-12,17H,6H2,1-2H3,(H2,22,30)(H2,23,31)(H2,26,27,28,29)/t17-/m1/s1