N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-5-ethyl-thiophene-2-sulfonamide

Systemtic Name: N-(3,5-dimethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)-5-ethyl-thiophene-2-sulfonamide Openeye Name: N-(3,5-dimethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)-5-ethyl-thiophene-2-sulfonamide CAS Name: N-(3,5-dimethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)-5-ethyl-2-thiophenesulfonamide IUPAC Name: N-(3,5-dimethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)-5-ethylthiophene-2-sulfonamide Traditional Name: 5-ethyl-N-(6-keto-3,5-dimethyl-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=C(C=C(C=C4)C)N(C3=O)C

Isomeric SMILES

CCC1=CC=C(S1)S(=O)(=O)NC2=CC3=C(C=C2)OC4=C(C=C(C=C4)C)N(C3=O)C

InChI

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