4-[2-(2-azanyl-3-cyano-phenyl)-5-bromanyl-pyrimidin-4-yl]oxy-3,5-dimethyl-benzenecarbonitrile

Systemtic Name: 4-[2-(2-azanyl-3-cyano-phenyl)-5-bromanyl-pyrimidin-4-yl]oxy-3,5-dimethyl-benzenecarbonitrile Openeye Name: 4-[2-(2-amino-3-cyano-phenyl)-5-bromo-pyrimidin-4-yl]oxy-3,5-dimethyl-benzonitrile CAS Name: 4-[[2-(2-amino-3-cyanophenyl)-5-bromo-4-pyrimidinyl]oxy]-3,5-dimethylbenzonitrile IUPAC Name: 4-[2-(2-amino-3-cyanophenyl)-5-bromopyrimidin-4-yl]oxy-3,5-dimethylbenzonitrile Traditional Name: 4-[2-(2-amino-3-cyano-phenyl)-5-bromo-pyrimidin-4-yl]oxy-3,5-dimethyl-benzonitrile Formula: C20H14BrN5O MolecularWeight: 420.26206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=NC(=NC=C2Br)C3=CC=CC(=C3N)C#N)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1OC2=NC(=NC=C2Br)C3=CC=CC(=C3N)C#N)C)C#N

InChI

InChI=1S/C20H14BrN5O/c1-11-6-13(8-22)7-12(2)18(11)27-20-16(21)10-25-19(26-20)15-5-3-4-14(9-23)17(15)24/h3-7,10H,24H2,1-2H3