N-[4-(cyclopropylmethyl)-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide

Systemtic Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxidanylidene-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide CAS Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-oxo-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Traditional Name: N-[4-(cyclopropylmethyl)-2-ethyl-3-keto-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)CC4CC4

Isomeric SMILES

CCC1C(=O)N(CC2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)CC4CC4

InChI

InChI=1S/C21H24N2O4S/c1-2-19-21(24)23(13-15-8-9-15)14-16-12-17(10-11-20(16)27-19)22-28(25,26)18-6-4-3-5-7-18/h3-7,10-12,15,19,22H,2,8-9,13-14H2,1H3