N-(4-fluoranyl-3-nitro-phenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetamide Formula: C15H9FN4O5S2 MolecularWeight: 408.384163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C15H9FN4O5S2/c16-10-3-1-8(5-12(10)20(24)25)17-14(21)7-26-15-18-11-4-2-9(19(22)23)6-13(11)27-15/h1-6H,7H2,(H,17,21)