4-[3,5-bis(bromanyl)-4-methoxy-phenyl]-N-(3-fluorophenyl)pyrimidin-2-amine

Systemtic Name: 4-[3,5-bis(bromanyl)-4-methoxy-phenyl]-N-(3-fluorophenyl)pyrimidin-2-amine Openeye Name: 4-(3,5-dibromo-4-methoxy-phenyl)-N-(3-fluorophenyl)pyrimidin-2-amine CAS Name: 4-(3,5-dibromo-4-methoxyphenyl)-N-(3-fluorophenyl)-2-pyrimidinamine IUPAC Name: 4-(3,5-dibromo-4-methoxyphenyl)-N-(3-fluorophenyl)pyrimidin-2-amine Traditional Name: [4-(3,5-dibromo-4-methoxy-phenyl)pyrimidin-2-yl]-(3-fluorophenyl)amine Formula: C17H12Br2FN3O MolecularWeight: 453.103083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Br)C2=NC(=NC=C2)NC3=CC(=CC=C3)F)Br

Isomeric SMILES

COC1=C(C=C(C=C1Br)C2=NC(=NC=C2)NC3=CC(=CC=C3)F)Br

InChI

InChI=1S/C17H12Br2FN3O/c1-24-16-13(18)7-10(8-14(16)19)15-5-6-21-17(23-15)22-12-4-2-3-11(20)9-12/h2-9H,1H3,(H,21,22,23)