2-(azepan-1-yl)-3-phenyl-1-benzothiophene 1,1-dioxide

Systemtic Name: 2-(azepan-1-yl)-3-phenyl-1-benzothiophene 1,1-dioxide Openeye Name: 2-(azepan-1-yl)-3-phenyl-benzothiophene 1,1-dioxide CAS Name: 2-(1-azepanyl)-3-phenyl-1-benzothiophene 1,1-dioxide IUPAC Name: 2-(azepan-1-yl)-3-phenyl-1-benzothiophene 1,1-dioxide Traditional Name: 2-(azepan-1-yl)-3-phenyl-benzothiophene 1,1-dioxide Formula: C20H21NO2S MolecularWeight: 339.45124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C3=CC=CC=C3S2(=O)=O)C4=CC=CC=C4

InChI

InChI=1S/C20H21NO2S/c22-24(23)18-13-7-6-12-17(18)19(16-10-4-3-5-11-16)20(24)21-14-8-1-2-9-15-21/h3-7,10-13H,1-2,8-9,14-15H2