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

Systemtic Name: N-(4-methylcyclohexyl)-4-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide Openeye Name: N-(4-methylcyclohexyl)-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide CAS Name: N-(4-methylcyclohexyl)-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide IUPAC Name: N-(4-methylcyclohexyl)-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-(4-methylcyclohexyl)butyramide Formula: C21H31N3O4S MolecularWeight: 421.55354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

Isomeric SMILES

CC1CCC(CC1)NC(=O)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)CCC3

InChI

InChI=1S/C21H31N3O4S/c1-15-7-9-17(10-8-15)23-20(25)6-3-13-22-29(27,28)18-11-12-19-16(14-18)4-2-5-21(26)24-19/h11-12,14-15,17,22H,2-10,13H2,1H3,(H,23,25)(H,24,26)