N-[(2-methoxyphenyl)methyl]-4-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-4-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide Openeye Name: N-[(2-methoxyphenyl)methyl]-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide CAS Name: N-[(2-methoxyphenyl)methyl]-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide Traditional Name: 4-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]-N-o-anisyl-butyramide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

InChI

InChI=1S/C22H27N3O5S/c1-30-20-8-3-2-6-17(20)15-23-21(26)10-5-13-24-31(28,29)18-11-12-19-16(14-18)7-4-9-22(27)25-19/h2-3,6,8,11-12,14,24H,4-5,7,9-10,13,15H2,1H3,(H,23,26)(H,25,27)