N-ethyl-N-[(4S,6S)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]-2-nitro-benzenesulfonamide

Systemtic Name: N-ethyl-N-[(4S,6S)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]-2-nitro-benzenesulfonamide Openeye Name: N-ethyl-N-[(4S,6S)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]-2-nitro-benzenesulfonamide CAS Name: N-ethyl-N-[(4S,6S)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]-2-nitrobenzenesulfonamide IUPAC Name: N-ethyl-N-[(4S,6S)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]-2-nitrobenzenesulfonamide Traditional Name: N-ethyl-N-[(4S,6S)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-4-yl]-2-nitro-benzenesulfonamide Formula: C16H18N2O4S3 MolecularWeight: 398.52012

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CC(SC2=C1C=CS2)C)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCN([C@H]1C[C@@H](SC2=C1C=CS2)C)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O4S3/c1-3-17(14-10-11(2)24-16-12(14)8-9-23-16)25(21,22)15-7-5-4-6-13(15)18(19)20/h4-9,11,14H,3,10H2,1-2H3/t11-,14-/m0/s1