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

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-3-methyl-2-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-3-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide CAS Name: N-(3-fluoro-4-methylphenyl)-3-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-3-methyl-2-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]-3-methyl-butyramide Formula: C22H26FN3O4S MolecularWeight: 447.522943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3)F

InChI

InChI=1S/C22H26FN3O4S/c1-13(2)21(22(28)24-16-8-7-14(3)18(23)12-16)26-31(29,30)17-9-10-19-15(11-17)5-4-6-20(27)25-19/h7-13,21,26H,4-6H2,1-3H3,(H,24,28)(H,25,27)