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

Systemtic Name: 5-chloranyl-N-(3-methyl-6-oxidanylidene-5H-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide Openeye Name: 5-chloro-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide CAS Name: 5-chloro-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)-2-thiophenesulfonamide IUPAC Name: 5-chloro-N-(3-methyl-6-oxo-5H-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide Traditional Name: 5-chloro-N-(6-keto-3-methyl-5H-benzo[b][1,4]benzoxazepin-8-yl)thiophene-2-sulfonamide Formula: C18H13ClN2O4S2 MolecularWeight: 420.88982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl)C(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1)OC3=C(C=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl)C(=O)N2

InChI

InChI=1S/C18H13ClN2O4S2/c1-10-2-4-15-13(8-10)20-18(22)12-9-11(3-5-14(12)25-15)21-27(23,24)17-7-6-16(19)26-17/h2-9,21H,1H3,(H,20,22)