2-[[5-azanyl-6-[(2-bromanyl-4-propan-2-yl-phenyl)amino]-2-methyl-pyrimidin-4-yl]amino]-N,N-dimethyl-pentanamide

Systemtic Name: 2-[[5-azanyl-6-[(2-bromanyl-4-propan-2-yl-phenyl)amino]-2-methyl-pyrimidin-4-yl]amino]-N,N-dimethyl-pentanamide Openeye Name: 2-[[5-amino-6-(2-bromo-4-isopropyl-anilino)-2-methyl-pyrimidin-4-yl]amino]-N,N-dimethyl-pentanamide CAS Name: 2-[[5-amino-6-(2-bromo-4-propan-2-ylanilino)-2-methyl-4-pyrimidinyl]amino]-N,N-dimethylpentanamide IUPAC Name: 2-[[5-amino-6-(2-bromo-4-propan-2-ylanilino)-2-methylpyrimidin-4-yl]amino]-N,N-dimethylpentanamide Traditional Name: 2-[[5-amino-6-(2-bromo-4-isopropyl-anilino)-2-methyl-pyrimidin-4-yl]amino]-N,N-dimethyl-valeramide Formula: C21H31BrN6O MolecularWeight: 463.41444

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N(C)C)NC1=NC(=NC(=C1N)NC2=C(C=C(C=C2)C(C)C)Br)C

Isomeric SMILES

CCCC(C(=O)N(C)C)NC1=NC(=NC(=C1N)NC2=C(C=C(C=C2)C(C)C)Br)C

InChI

InChI=1S/C21H31BrN6O/c1-7-8-17(21(29)28(5)6)27-20-18(23)19(24-13(4)25-20)26-16-10-9-14(12(2)3)11-15(16)22/h9-12,17H,7-8,23H2,1-6H3,(H2,24,25,26,27)