5-[4-(3-bromanyl-4-fluoranyl-phenyl)-1-propan-2-yl-benzotriazol-5-yl]-1,3-oxazole

Systemtic Name: 5-[4-(3-bromanyl-4-fluoranyl-phenyl)-1-propan-2-yl-benzotriazol-5-yl]-1,3-oxazole Openeye Name: 5-[4-(3-bromo-4-fluoro-phenyl)-1-isopropyl-benzotriazol-5-yl]oxazole CAS Name: 5-[4-(3-bromo-4-fluorophenyl)-1-propan-2-yl-5-benzotriazolyl]oxazole IUPAC Name: 5-[4-(3-bromo-4-fluorophenyl)-1-propan-2-ylbenzotriazol-5-yl]-1,3-oxazole Traditional Name: 5-[4-(3-bromo-4-fluoro-phenyl)-1-isopropyl-benzotriazol-5-yl]oxazole Formula: C18H14BrFN4O MolecularWeight: 401.232363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=C(C=C2)C3=CN=CO3)C4=CC(=C(C=C4)F)Br)N=N1

Isomeric SMILES

CC(C)N1C2=C(C(=C(C=C2)C3=CN=CO3)C4=CC(=C(C=C4)F)Br)N=N1

InChI

InChI=1S/C18H14BrFN4O/c1-10(2)24-15-6-4-12(16-8-21-9-25-16)17(18(15)22-23-24)11-3-5-14(20)13(19)7-11/h3-10H,1-2H3