4-[[4-[(4-bromophenyl)-cyano-methyl]-6-methyl-pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[(4-bromophenyl)-cyano-methyl]-6-methyl-pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[(4-bromophenyl)-cyano-methyl]-6-methyl-pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[(4-bromophenyl)-cyanomethyl]-6-methyl-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[(4-bromophenyl)-cyanomethyl]-6-methylpyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[(4-bromophenyl)-cyano-methyl]-6-methyl-pyrimidin-2-yl]amino]benzonitrile Formula: C20H14BrN5 MolecularWeight: 404.26266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C#N)C(C#N)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)C#N)C(C#N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H14BrN5/c1-13-10-19(18(12-23)15-4-6-16(21)7-5-15)26-20(24-13)25-17-8-2-14(11-22)3-9-17/h2-10,18H,1H3,(H,24,25,26)