1-[(2-azanylpyridin-4-yl)methyl]-6-(3-bromanyl-5-methyl-phenyl)carbonyl-5-propan-2-yl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2-azanylpyridin-4-yl)methyl]-6-(3-bromanyl-5-methyl-phenyl)carbonyl-5-propan-2-yl-pyrimidine-2,4-dione Openeye Name: 1-[(2-amino-4-pyridyl)methyl]-6-(3-bromo-5-methyl-benzoyl)-5-isopropyl-pyrimidine-2,4-dione CAS Name: 1-[(2-amino-4-pyridinyl)methyl]-6-[(3-bromo-5-methylphenyl)-oxomethyl]-5-propan-2-ylpyrimidine-2,4-dione IUPAC Name: 1-[(2-aminopyridin-4-yl)methyl]-6-(3-bromo-5-methylbenzoyl)-5-propan-2-ylpyrimidine-2,4-dione Traditional Name: 1-[(2-amino-4-pyridyl)methyl]-6-(3-bromo-5-methyl-benzoyl)-5-isopropyl-pyrimidine-2,4-quinone Formula: C21H21BrN4O3 MolecularWeight: 457.32044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CC3=CC(=NC=C3)N)C(C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C2=C(C(=O)NC(=O)N2CC3=CC(=NC=C3)N)C(C)C)Br

InChI

InChI=1S/C21H21BrN4O3/c1-11(2)17-18(19(27)14-6-12(3)7-15(22)9-14)26(21(29)25-20(17)28)10-13-4-5-24-16(23)8-13/h4-9,11H,10H2,1-3H3,(H2,23,24)(H,25,28,29)