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

Systemtic Name: 5-[2-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[2-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[2-(1-azepanylsulfonyl)phenyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[2-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[2-(azepan-1-ylsulfonyl)phenyl]-3-phenyl-1,2,4-oxadiazole Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC=C2C3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC=C2C3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C20H21N3O3S/c24-27(25,23-14-8-1-2-9-15-23)18-13-7-6-12-17(18)20-21-19(22-26-20)16-10-4-3-5-11-16/h3-7,10-13H,1-2,8-9,14-15H2