3-(azepan-1-ylsulfonyl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[(3S)-1,1-dioxothiolan-3-yl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[(3S)-1,1-dioxo-3-thiolanyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[(3S)-1,1-dioxothiolan-3-yl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[(3S)-1,1-diketothiolan-3-yl]benzamide Formula: C17H24N2O5S2 MolecularWeight: 400.51286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3CCS(=O)(=O)C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C17H24N2O5S2/c20-17(18-15-8-11-25(21,22)13-15)14-6-5-7-16(12-14)26(23,24)19-9-3-1-2-4-10-19/h5-7,12,15H,1-4,8-11,13H2,(H,18,20)/t15-/m0/s1