N-(4-ethanoylphenyl)-4-[[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide

Systemtic Name: N-(4-ethanoylphenyl)-4-[[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide Openeye Name: N-(4-acetylphenyl)-4-[[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexanecarboxamide CAS Name: N-(4-acetylphenyl)-4-[[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]-1-cyclohexanecarboxamide IUPAC Name: N-(4-acetylphenyl)-4-[[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide Traditional Name: N-(4-acetylphenyl)-4-[[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]methyl]cyclohexanecarboxamide Formula: C26H31N3O5S MolecularWeight: 497.60644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=O)C2CCC(CC2)CNS(=O)(=O)C3=CC4=C(C=C3)NC(=O)CCC4

InChI

InChI=1S/C26H31N3O5S/c1-17(30)19-9-11-22(12-10-19)28-26(32)20-7-5-18(6-8-20)16-27-35(33,34)23-13-14-24-21(15-23)3-2-4-25(31)29-24/h9-15,18,20,27H,2-8,16H2,1H3,(H,28,32)(H,29,31)