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

Systemtic Name: 2-[[(2R)-1-azanyl-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-[(4-imidazol-1-ylphenyl)amino]pyrimidine-5-carboxamide Openeye Name: 2-[[(1R)-1-carbamoyl-3-methyl-butyl]amino]-4-(4-imidazol-1-ylanilino)pyrimidine-5-carboxamide CAS Name: 2-[[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-4-[4-(1-imidazolyl)anilino]-5-pyrimidinecarboxamide IUPAC Name: 2-[[(2R)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-4-(4-imidazol-1-ylanilino)pyrimidine-5-carboxamide Traditional Name: 2-[[(1R)-1-carbamoyl-3-methyl-butyl]amino]-4-(4-imidazol-1-ylanilino)pyrimidine-5-carboxamide Formula: C20H24N8O2 MolecularWeight: 408.45696

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=C(C=C2)N3C=CN=C3)C(=O)N

Isomeric SMILES

CC(C)C[C@H](C(=O)N)NC1=NC=C(C(=N1)NC2=CC=C(C=C2)N3C=CN=C3)C(=O)N

InChI

InChI=1S/C20H24N8O2/c1-12(2)9-16(18(22)30)26-20-24-10-15(17(21)29)19(27-20)25-13-3-5-14(6-4-13)28-8-7-23-11-28/h3-8,10-12,16H,9H2,1-2H3,(H2,21,29)(H2,22,30)(H2,24,25,26,27)/t16-/m1/s1