2-[[(1R,2S)-2-azanylcyclohexyl]amino]-4-oxidanylidene-6-[(3-pyrimidin-2-ylphenyl)amino]-1H-pyrimidine-5-carboxamide

Systemtic Name: 2-[[(1R,2S)-2-azanylcyclohexyl]amino]-4-oxidanylidene-6-[(3-pyrimidin-2-ylphenyl)amino]-1H-pyrimidine-5-carboxamide Openeye Name: 2-[[(1R,2S)-2-aminocyclohexyl]amino]-4-oxo-6-(3-pyrimidin-2-ylanilino)-1H-pyrimidine-5-carboxamide CAS Name: 2-[[(1R,2S)-2-aminocyclohexyl]amino]-4-oxo-6-[3-(2-pyrimidinyl)anilino]-1H-pyrimidine-5-carboxamide IUPAC Name: 2-[[(1R,2S)-2-aminocyclohexyl]amino]-4-oxo-6-(3-pyrimidin-2-ylanilino)-1H-pyrimidine-5-carboxamide Traditional Name: 2-[[(1R,2S)-2-aminocyclohexyl]amino]-4-keto-6-[3-(2-pyrimidyl)anilino]-1H-pyrimidine-5-carboxamide Formula: C21H24N8O2 MolecularWeight: 420.46766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NC2=NC(=O)C(=C(N2)NC3=CC=CC(=C3)C4=NC=CC=N4)C(=O)N

Isomeric SMILES

C1CC[C@H]([C@H](C1)N)NC2=NC(=O)C(=C(N2)NC3=CC=CC(=C3)C4=NC=CC=N4)C(=O)N

InChI

InChI=1S/C21H24N8O2/c22-14-7-1-2-8-15(14)27-21-28-19(16(17(23)30)20(31)29-21)26-13-6-3-5-12(11-13)18-24-9-4-10-25-18/h3-6,9-11,14-15H,1-2,7-8,22H2,(H2,23,30)(H3,26,27,28,29,31)/t14-,15+/m0/s1