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

Systemtic Name: 3-oxidanylidene-N-[2-(phenylmethylsulfanyl)ethyl]-4H-1,4-benzoxazine-6-sulfonamide Openeye Name: N-(2-benzylsulfanylethyl)-3-oxo-4H-1,4-benzoxazine-6-sulfonamide CAS Name: 3-oxo-N-[2-(phenylmethylthio)ethyl]-4H-1,4-benzoxazine-6-sulfonamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-oxo-4H-1,4-benzoxazine-6-sulfonamide Traditional Name: N-[2-(benzylthio)ethyl]-3-keto-4H-1,4-benzoxazine-6-sulfonamide Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O4S2/c20-17-11-23-16-7-6-14(10-15(16)19-17)25(21,22)18-8-9-24-12-13-4-2-1-3-5-13/h1-7,10,18H,8-9,11-12H2,(H,19,20)