6-(4-fluorophenyl)-N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-pyridine-3-carboxamide

Systemtic Name: 6-(4-fluorophenyl)-N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-pyridine-3-carboxamide Openeye Name: 6-(4-fluorophenyl)-N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonyl-pyridine-3-carboxamide CAS Name: 6-(4-fluorophenyl)-N-[3-nitro-4-[2-(phenylthio)ethylamino]phenyl]sulfonyl-3-pyridinecarboxamide IUPAC Name: 6-(4-fluorophenyl)-N-[3-nitro-4-(2-phenylsulfanylethylamino)phenyl]sulfonylpyridine-3-carboxamide Traditional Name: 6-(4-fluorophenyl)-N-[3-nitro-4-[2-(phenylthio)ethylamino]phenyl]sulfonyl-nicotinamide Formula: C26H21FN4O5S2 MolecularWeight: 552.597143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCNC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CN=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C26H21FN4O5S2/c27-20-9-6-18(7-10-20)23-12-8-19(17-29-23)26(32)30-38(35,36)22-11-13-24(25(16-22)31(33)34)28-14-15-37-21-4-2-1-3-5-21/h1-13,16-17,28H,14-15H2,(H,30,32)