2-[5-(azepan-1-ylsulfonyl)-2-fluoranyl-phenyl]-5-phenyl-1,3,4-oxadiazole

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)-2-fluoranyl-phenyl]-5-phenyl-1,3,4-oxadiazole Openeye Name: 2-[5-(azepan-1-ylsulfonyl)-2-fluoro-phenyl]-5-phenyl-1,3,4-oxadiazole CAS Name: 2-[5-(1-azepanylsulfonyl)-2-fluorophenyl]-5-phenyl-1,3,4-oxadiazole IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)-2-fluorophenyl]-5-phenyl-1,3,4-oxadiazole Traditional Name: 2-[5-(azepan-1-ylsulfonyl)-2-fluoro-phenyl]-5-phenyl-1,3,4-oxadiazole Formula: C20H20FN3O3S MolecularWeight: 401.454503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)C3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)C3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C20H20FN3O3S/c21-18-11-10-16(28(25,26)24-12-6-1-2-7-13-24)14-17(18)20-23-22-19(27-20)15-8-4-3-5-9-15/h3-5,8-11,14H,1-2,6-7,12-13H2