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

Systemtic Name: N-[2-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]amino]-2-oxidanylidene-ethyl]-3-methyl-benzamide Openeye Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-oxo-ethyl]-3-methyl-benzamide CAS Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-oxoethyl]-3-methylbenzamide IUPAC Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-oxoethyl]-3-methylbenzamide Traditional Name: N-[2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]-2-keto-ethyl]-3-methyl-benzamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H25N3O6S/c1-17-4-2-5-18(14-17)25(30)26-16-24(29)27-19-6-8-20(9-7-19)28-35(31,32)21-10-11-22-23(15-21)34-13-3-12-33-22/h2,4-11,14-15,28H,3,12-13,16H2,1H3,(H,26,30)(H,27,29)