4-[[4-azanyl-6-[(4-chloranyl-2,6-dimethyl-phenyl)amino]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-[(4-chloranyl-2,6-dimethyl-phenyl)amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-(4-chloro-2,6-dimethyl-anilino)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-(4-chloro-2,6-dimethylanilino)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-(4-chloro-2,6-dimethylanilino)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-(4-chloro-2,6-dimethyl-anilino)pyrimidin-2-yl]amino]benzonitrile Formula: C19H17ClN6 MolecularWeight: 364.83148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC(=NC(=C2)N)NC3=CC=C(C=C3)C#N)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC(=NC(=C2)N)NC3=CC=C(C=C3)C#N)C)Cl

InChI

InChI=1S/C19H17ClN6/c1-11-7-14(20)8-12(2)18(11)25-17-9-16(22)24-19(26-17)23-15-5-3-13(10-21)4-6-15/h3-9H,1-2H3,(H4,22,23,24,25,26)