N-[1-(5-chloranylthiophen-2-yl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide

Systemtic Name: N-[1-(5-chloranylthiophen-2-yl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Openeye Name: N-[1-(5-chloro-2-thienyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide CAS Name: N-[1-(5-chloro-2-thiophenyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide IUPAC Name: N-[1-(5-chlorothiophen-2-yl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Traditional Name: N-[1-(5-chloro-2-thienyl)ethyl]-4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Formula: C22H21ClN2O5S2 MolecularWeight: 492.99554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(S1)Cl)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C1=CC=C(S1)Cl)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C22H21ClN2O5S2/c1-14(20-9-10-21(23)31-20)24-22(26)15-3-5-16(6-4-15)25-32(27,28)17-7-8-18-19(13-17)30-12-2-11-29-18/h3-10,13-14,25H,2,11-12H2,1H3,(H,24,26)