2-azanyl-3-[4-[[2,6-bis(bromanyl)-4-propyl-phenyl]amino]pyrimidin-2-yl]benzenecarbonitrile

Systemtic Name: 2-azanyl-3-[4-[[2,6-bis(bromanyl)-4-propyl-phenyl]amino]pyrimidin-2-yl]benzenecarbonitrile Openeye Name: 2-amino-3-[4-(2,6-dibromo-4-propyl-anilino)pyrimidin-2-yl]benzonitrile CAS Name: 2-amino-3-[4-(2,6-dibromo-4-propylanilino)-2-pyrimidinyl]benzonitrile IUPAC Name: 2-amino-3-[4-(2,6-dibromo-4-propylanilino)pyrimidin-2-yl]benzonitrile Traditional Name: 2-amino-3-[4-(2,6-dibromo-4-propyl-anilino)pyrimidin-2-yl]benzonitrile Formula: C20H17Br2N5 MolecularWeight: 487.19048

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)Br)NC2=NC(=NC=C2)C3=CC=CC(=C3N)C#N)Br

Isomeric SMILES

CCCC1=CC(=C(C(=C1)Br)NC2=NC(=NC=C2)C3=CC=CC(=C3N)C#N)Br

InChI

InChI=1S/C20H17Br2N5/c1-2-4-12-9-15(21)19(16(22)10-12)26-17-7-8-25-20(27-17)14-6-3-5-13(11-23)18(14)24/h3,5-10H,2,4,24H2,1H3,(H,25,26,27)