N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-thiophen-2-ylsulfonyl-cyclohexanecarboxamide

Systemtic Name: N-(2-oxidanylidene-1,3-benzoxathiol-5-yl)-N-thiophen-2-ylsulfonyl-cyclohexanecarboxamide Openeye Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-(2-thienylsulfonyl)cyclohexanecarboxamide CAS Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-thiophen-2-ylsulfonylcyclohexanecarboxamide IUPAC Name: N-(2-oxo-1,3-benzoxathiol-5-yl)-N-thiophen-2-ylsulfonylcyclohexanecarboxamide Traditional Name: N-(2-keto-1,3-benzoxathiol-5-yl)-N-(2-thienylsulfonyl)cyclohexanecarboxamide Formula: C18H17NO5S3 MolecularWeight: 423.52628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(C2=CC3=C(C=C2)OC(=O)S3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(CC1)C(=O)N(C2=CC3=C(C=C2)OC(=O)S3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H17NO5S3/c20-17(12-5-2-1-3-6-12)19(27(22,23)16-7-4-10-25-16)13-8-9-14-15(11-13)26-18(21)24-14/h4,7-12H,1-3,5-6H2