4-[[4-[(2,6-dimethylphenyl)amino]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[(2,6-dimethylphenyl)amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(2,6-dimethylanilino)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(2,6-dimethylanilino)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-(2,6-dimethylanilino)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(2,6-dimethylanilino)pyrimidin-2-yl]amino]benzonitrile Formula: C19H17N5 MolecularWeight: 315.37178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H17N5/c1-13-4-3-5-14(2)18(13)23-17-10-11-21-19(24-17)22-16-8-6-15(12-20)7-9-16/h3-11H,1-2H3,(H2,21,22,23,24)