5-ethyl-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide

Systemtic Name: 5-ethyl-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide Openeye Name: 5-ethyl-N-(5-ethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide CAS Name: 5-ethyl-N-(5-ethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-2-thiophenesulfonamide IUPAC Name: 5-ethyl-N-(5-ethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide Traditional Name: 5-ethyl-N-(5-ethyl-6-keto-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)S(=O)(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C4N(C3=O)CC

Isomeric SMILES

CCC1=CC=C(S1)S(=O)(=O)NC2=CC3=C(C=C2)OC4=CC=CC=C4N(C3=O)CC

InChI

InChI=1S/C21H20N2O4S2/c1-3-15-10-12-20(28-15)29(25,26)22-14-9-11-18-16(13-14)21(24)23(4-2)17-7-5-6-8-19(17)27-18/h5-13,22H,3-4H2,1-2H3