N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(1,3-dithiolan-2-yl)phenoxy]ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(1,3-dithiolan-2-yl)phenoxy]acetamide Formula: C23H28N2O4S3 MolecularWeight: 492.67442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=C(C=C3)C4SCCS4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)COC3=CC=C(C=C3)C4SCCS4

InChI

InChI=1S/C23H28N2O4S3/c26-22(17-29-20-9-5-18(6-10-20)23-30-15-16-31-23)24-19-7-11-21(12-8-19)32(27,28)25-13-3-1-2-4-14-25/h5-12,23H,1-4,13-17H2,(H,24,26)