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

Systemtic Name: 4-[[4-[(4-chloranyl-2,6-dimethyl-phenyl)amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(4-chloro-2,6-dimethyl-anilino)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(4-chloro-2,6-dimethylanilino)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-(4-chloro-2,6-dimethylanilino)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(4-chloro-2,6-dimethyl-anilino)pyrimidin-2-yl]amino]benzonitrile Formula: C19H16ClN5 MolecularWeight: 349.81684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClN5/c1-12-9-15(20)10-13(2)18(12)24-17-7-8-22-19(25-17)23-16-5-3-14(11-21)4-6-16/h3-10H,1-2H3,(H2,22,23,24,25)