N-[4-(3-bromanyl-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide

Systemtic Name: N-[4-(3-bromanyl-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide Openeye Name: N-[4-(3-bromo-2-fluoro-phenyl)thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide CAS Name: N-[4-(3-bromo-2-fluorophenyl)-2-thiazolyl]-4-(4-pyrimidinylamino)benzamide IUPAC Name: N-[4-(3-bromo-2-fluorophenyl)-1,3-thiazol-2-yl]-4-(pyrimidin-4-ylamino)benzamide Traditional Name: N-[4-(3-bromo-2-fluoro-phenyl)thiazol-2-yl]-4-(4-pyrimidylamino)benzamide Formula: C20H13BrFN5OS MolecularWeight: 470.317523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Br)F)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)NC4=NC=NC=C4

Isomeric SMILES

C1=CC(=C(C(=C1)Br)F)C2=CSC(=N2)NC(=O)C3=CC=C(C=C3)NC4=NC=NC=C4

InChI

InChI=1S/C20H13BrFN5OS/c21-15-3-1-2-14(18(15)22)16-10-29-20(26-16)27-19(28)12-4-6-13(7-5-12)25-17-8-9-23-11-24-17/h1-11H,(H,23,24,25)(H,26,27,28)