N-[2-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]amino]-2-oxidanylidene-ethyl]furan-2-carboxamide

Systemtic Name: N-[2-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]amino]-2-oxidanylidene-ethyl]furan-2-carboxamide Openeye Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-oxoethyl]-2-furancarboxamide IUPAC Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-oxoethyl]furan-2-carboxamide Traditional Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-keto-ethyl]-2-furamide Formula: C22H21N3O7S MolecularWeight: 471.48304

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)CNC(=O)C4=CC=CO4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)CNC(=O)C4=CC=CO4)OC1

InChI

InChI=1S/C22H21N3O7S/c26-21(14-23-22(27)19-3-1-10-31-19)24-15-4-6-16(7-5-15)25-33(28,29)17-8-9-18-20(13-17)32-12-2-11-30-18/h1,3-10,13,25H,2,11-12,14H2,(H,23,27)(H,24,26)