3-oxidanylidene-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-4H-1,4-benzoxazine-6-sulfonamide

Systemtic Name: 3-oxidanylidene-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: 3-oxo-N-[2-(2-thienylmethylsulfanyl)ethyl]-4H-1,4-benzoxazine-6-sulfonamide CAS Name: 3-oxo-N-[2-(thiophen-2-ylmethylthio)ethyl]-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: 3-oxo-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: 3-keto-N-[2-(2-thenylthio)ethyl]-4H-1,4-benzoxazine-6-sulfonamide Formula: C15H16N2O4S3 MolecularWeight: 384.49354

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCSCC3=CC=CS3

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C15H16N2O4S3/c18-15-9-21-14-4-3-12(8-13(14)17-15)24(19,20)16-5-7-22-10-11-2-1-6-23-11/h1-4,6,8,16H,5,7,9-10H2,(H,17,18)