6-[(5-bromanylpyridin-3-yl)methylamino]-2-methyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-[(5-bromanylpyridin-3-yl)methylamino]-2-methyl-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-[(5-bromo-3-pyridyl)methylamino]-2-methyl-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-[(5-bromo-3-pyridinyl)methylamino]-2-methyl-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-[(5-bromopyridin-3-yl)methylamino]-2-methyl-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 6-[(5-bromo-3-pyridyl)methylamino]-4-keto-2-methyl-1H-pyrimidine-5-carbonitrile Formula: C12H10BrN5O MolecularWeight: 320.1447

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)NCC2=CC(=CN=C2)Br)C#N

Isomeric SMILES

CC1=NC(=O)C(=C(N1)NCC2=CC(=CN=C2)Br)C#N

InChI

InChI=1S/C12H10BrN5O/c1-7-17-11(10(3-14)12(19)18-7)16-5-8-2-9(13)6-15-4-8/h2,4,6H,5H2,1H3,(H2,16,17,18,19)