N-(8-fluoranyl-4-methyl-2-sulfanylidene-4,5-dihydro-1H-3,1-benzoxazepin-7-yl)thiophene-3-sulfonamide

Systemtic Name: N-(8-fluoranyl-4-methyl-2-sulfanylidene-4,5-dihydro-1H-3,1-benzoxazepin-7-yl)thiophene-3-sulfonamide Openeye Name: N-(8-fluoro-4-methyl-2-thioxo-4,5-dihydro-1H-3,1-benzoxazepin-7-yl)thiophene-3-sulfonamide CAS Name: N-(8-fluoro-4-methyl-2-sulfanylidene-4,5-dihydro-1H-3,1-benzoxazepin-7-yl)-3-thiophenesulfonamide IUPAC Name: N-(8-fluoro-4-methyl-2-sulfanylidene-4,5-dihydro-1H-3,1-benzoxazepin-7-yl)thiophene-3-sulfonamide Traditional Name: N-(8-fluoro-4-methyl-2-thioxo-4,5-dihydro-1H-3,1-benzoxazepin-7-yl)thiophene-3-sulfonamide Formula: C14H13FN2O3S3 MolecularWeight: 372.458023

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC(=C(C=C2NC(=S)O1)F)NS(=O)(=O)C3=CSC=C3

Isomeric SMILES

CC1CC2=CC(=C(C=C2NC(=S)O1)F)NS(=O)(=O)C3=CSC=C3

InChI

InChI=1S/C14H13FN2O3S3/c1-8-4-9-5-13(11(15)6-12(9)16-14(21)20-8)17-23(18,19)10-2-3-22-7-10/h2-3,5-8,17H,4H2,1H3,(H,16,21)