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

Systemtic Name: 4-[[4-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(2,6-dibromo-4-methyl-anilino)pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(2,6-dibromo-4-methylanilino)-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-(2,6-dibromo-4-methylanilino)pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(2,6-dibromo-4-methyl-anilino)pyrimidin-2-yl]amino]benzonitrile Formula: C18H13Br2N5 MolecularWeight: 459.13732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13Br2N5/c1-11-8-14(19)17(15(20)9-11)24-16-6-7-22-18(25-16)23-13-4-2-12(10-21)3-5-13/h2-9H,1H3,(H2,22,23,24,25)