N-[3-(azepan-1-ylsulfonyl)phenyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-1,1-dioxothiolane-3-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-1,1-diketo-thiolane-3-carboxamide Formula: C17H24N2O5S2 MolecularWeight: 400.51286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCS(=O)(=O)C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C3CCS(=O)(=O)C3

InChI

InChI=1S/C17H24N2O5S2/c20-17(14-8-11-25(21,22)13-14)18-15-6-5-7-16(12-15)26(23,24)19-9-3-1-2-4-10-19/h5-7,12,14H,1-4,8-11,13H2,(H,18,20)