N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-[2-(4-fluorophenyl)thiazol-4-yl]ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-[2-(4-fluorophenyl)-4-thiazolyl]ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-[2-(4-fluorophenyl)thiazol-4-yl]ethyl]-3-nitro-benzenesulfonamide Formula: C17H14FN3O4S2 MolecularWeight: 407.439163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCC2=CSC(=N2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCC2=CSC(=N2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H14FN3O4S2/c18-13-6-4-12(5-7-13)17-20-14(11-26-17)8-9-19-27(24,25)16-3-1-2-15(10-16)21(22)23/h1-7,10-11,19H,8-9H2