3-methyl-4-[[2-[(2,4,6-trimethylphenyl)amino]pyrimidin-4-yl]amino]benzenecarbonitrile

Systemtic Name: 3-methyl-4-[[2-[(2,4,6-trimethylphenyl)amino]pyrimidin-4-yl]amino]benzenecarbonitrile Openeye Name: 3-methyl-4-[[2-(2,4,6-trimethylanilino)pyrimidin-4-yl]amino]benzonitrile CAS Name: 3-methyl-4-[[2-(2,4,6-trimethylanilino)-4-pyrimidinyl]amino]benzonitrile IUPAC Name: 3-methyl-4-[[2-(2,4,6-trimethylanilino)pyrimidin-4-yl]amino]benzonitrile Traditional Name: 4-[(2-mesidinopyrimidin-4-yl)amino]-3-methyl-benzonitrile Formula: C21H21N5 MolecularWeight: 343.42494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=NC=CC(=N2)NC3=C(C=C(C=C3)C#N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=NC=CC(=N2)NC3=C(C=C(C=C3)C#N)C)C

InChI

InChI=1S/C21H21N5/c1-13-9-15(3)20(16(4)10-13)26-21-23-8-7-19(25-21)24-18-6-5-17(12-22)11-14(18)2/h5-11H,1-4H3,(H2,23,24,25,26)