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

Systemtic Name: 4-[(2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide CAS Name: 4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-[(2-oxo-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butanamide Traditional Name: N-benzyl-4-[(2-keto-1,3,4,5-tetrahydro-1-benzazepin-7-yl)sulfonylamino]butyramide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)S(=O)(=O)NCCCC(=O)NCC3=CC=CC=C3)NC(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)S(=O)(=O)NCCCC(=O)NCC3=CC=CC=C3)NC(=O)C1

InChI

InChI=1S/C21H25N3O4S/c25-20(22-15-16-6-2-1-3-7-16)10-5-13-23-29(27,28)18-11-12-19-17(14-18)8-4-9-21(26)24-19/h1-3,6-7,11-12,14,23H,4-5,8-10,13,15H2,(H,22,25)(H,24,26)