N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-[2-(methanesulfonamido)ethyl]-2-thiophenecarboxamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Formula: C17H19ClN2O5S2 MolecularWeight: 430.92616

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NC2=CC3=C(C=C2Cl)OCCCO3

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NC2=CC3=C(C=C2Cl)OCCCO3

InChI

InChI=1S/C17H19ClN2O5S2/c1-27(22,23)19-6-5-11-3-4-16(26-11)17(21)20-13-10-15-14(9-12(13)18)24-7-2-8-25-15/h3-4,9-10,19H,2,5-8H2,1H3,(H,20,21)