4-[(2-azanyl-5-bromanyl-6-methyl-pyrimidin-4-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(2-azanyl-5-bromanyl-6-methyl-pyrimidin-4-yl)amino]benzenecarbonitrile Openeye Name: 4-[(2-amino-5-bromo-6-methyl-pyrimidin-4-yl)amino]benzonitrile CAS Name: 4-[(2-amino-5-bromo-6-methyl-4-pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[(2-amino-5-bromo-6-methylpyrimidin-4-yl)amino]benzonitrile Traditional Name: 4-[(2-amino-5-bromo-6-methyl-pyrimidin-4-yl)amino]benzonitrile Formula: C12H10BrN5 MolecularWeight: 304.1453

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N)NC2=CC=C(C=C2)C#N)Br

Isomeric SMILES

CC1=C(C(=NC(=N1)N)NC2=CC=C(C=C2)C#N)Br

InChI

InChI=1S/C12H10BrN5/c1-7-10(13)11(18-12(15)16-7)17-9-4-2-8(6-14)3-5-9/h2-5H,1H3,(H3,15,16,17,18)