N-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1,3,4-thiadiazol-2-yl]-4-(3-nitrophenyl)benzenesulfonamide

Systemtic Name: N-[5-(2-morpholin-4-yl-2-oxidanylidene-ethyl)-1,3,4-thiadiazol-2-yl]-4-(3-nitrophenyl)benzenesulfonamide Openeye Name: N-[5-(2-morpholino-2-oxo-ethyl)-1,3,4-thiadiazol-2-yl]-4-(3-nitrophenyl)benzenesulfonamide CAS Name: N-[5-[2-(4-morpholinyl)-2-oxoethyl]-1,3,4-thiadiazol-2-yl]-4-(3-nitrophenyl)benzenesulfonamide IUPAC Name: N-[5-(2-morpholin-4-yl-2-oxoethyl)-1,3,4-thiadiazol-2-yl]-4-(3-nitrophenyl)benzenesulfonamide Traditional Name: N-[5-(2-keto-2-morpholino-ethyl)-1,3,4-thiadiazol-2-yl]-4-(3-nitrophenyl)benzenesulfonamide Formula: C20H19N5O6S2 MolecularWeight: 489.52476

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CC2=NN=C(S2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)CC2=NN=C(S2)NS(=O)(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O6S2/c26-19(24-8-10-31-11-9-24)13-18-21-22-20(32-18)23-33(29,30)17-6-4-14(5-7-17)15-2-1-3-16(12-15)25(27)28/h1-7,12H,8-11,13H2,(H,22,23)