N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)-N-thiophen-2-ylsulfonyl-cyclohexanecarboxamide

Systemtic Name: N-(2-oxidanylidenebenzo[g][1,3]benzoxathiol-5-yl)-N-thiophen-2-ylsulfonyl-cyclohexanecarboxamide Openeye Name: N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)-N-(2-thienylsulfonyl)cyclohexanecarboxamide CAS Name: N-(2-oxo-5-benzo[g][1,3]benzoxathiolyl)-N-thiophen-2-ylsulfonylcyclohexanecarboxamide IUPAC Name: N-(2-oxobenzo[g][1,3]benzoxathiol-5-yl)-N-thiophen-2-ylsulfonylcyclohexanecarboxamide Traditional Name: N-(2-ketobenzo[g][1,3]benzoxathiol-5-yl)-N-(2-thienylsulfonyl)cyclohexanecarboxamide Formula: C22H19NO5S3 MolecularWeight: 473.58496

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(C2=CC3=C(C4=CC=CC=C42)OC(=O)S3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CCC(CC1)C(=O)N(C2=CC3=C(C4=CC=CC=C42)OC(=O)S3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H19NO5S3/c24-21(14-7-2-1-3-8-14)23(31(26,27)19-11-6-12-29-19)17-13-18-20(28-22(25)30-18)16-10-5-4-9-15(16)17/h4-6,9-14H,1-3,7-8H2