4-[[4-azanyl-6-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-azanyl-6-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-amino-6-(2,6-dibromo-4-methyl-anilino)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-amino-6-(2,6-dibromo-4-methylanilino)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-amino-6-(2,6-dibromo-4-methylanilino)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-amino-6-(2,6-dibromo-4-methyl-anilino)pyrimidin-2-yl]amino]benzonitrile Formula: C18H14Br2N6 MolecularWeight: 474.15196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14Br2N6/c1-10-6-13(19)17(14(20)7-10)25-16-8-15(22)24-18(26-16)23-12-4-2-11(9-21)3-5-12/h2-8H,1H3,(H4,22,23,24,25,26)