5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-fluorophenyl)-1,3-oxazole

Systemtic Name: 5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-fluorophenyl)-1,3-oxazole Openeye Name: 5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-fluorophenyl)oxazole CAS Name: 5-(1-azepanyl)-4-(4-bromophenyl)sulfonyl-2-(4-fluorophenyl)oxazole IUPAC Name: 5-(azepan-1-yl)-4-(4-bromophenyl)sulfonyl-2-(4-fluorophenyl)-1,3-oxazole Traditional Name: 5-(azepan-1-yl)-4-brosyl-2-(4-fluorophenyl)oxazole Formula: C21H20BrFN2O3S MolecularWeight: 479.362503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(N=C(O2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CCCN(CC1)C2=C(N=C(O2)C3=CC=C(C=C3)F)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H20BrFN2O3S/c22-16-7-11-18(12-8-16)29(26,27)20-21(25-13-3-1-2-4-14-25)28-19(24-20)15-5-9-17(23)10-6-15/h5-12H,1-4,13-14H2