2-azanyl-4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-5-methyl-3-pyrimidin-2-yl-benzenecarbonitrile

Systemtic Name: 2-azanyl-4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-5-methyl-3-pyrimidin-2-yl-benzenecarbonitrile Openeye Name: 2-amino-4-(4-bromo-2,6-dimethyl-anilino)-5-methyl-3-pyrimidin-2-yl-benzonitrile CAS Name: 2-amino-4-(4-bromo-2,6-dimethylanilino)-5-methyl-3-(2-pyrimidinyl)benzonitrile IUPAC Name: 2-amino-4-(4-bromo-2,6-dimethylanilino)-5-methyl-3-pyrimidin-2-ylbenzonitrile Traditional Name: 2-amino-4-(4-bromo-2,6-dimethyl-anilino)-5-methyl-3-(2-pyrimidyl)benzonitrile Formula: C20H18BrN5 MolecularWeight: 408.29442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=C(C=C(C(=C2C3=NC=CC=N3)N)C#N)C)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC2=C(C=C(C(=C2C3=NC=CC=N3)N)C#N)C)C)Br

InChI

InChI=1S/C20H18BrN5/c1-11-7-14(10-22)17(23)16(20-24-5-4-6-25-20)19(11)26-18-12(2)8-15(21)9-13(18)3/h4-9,26H,23H2,1-3H3