4-(4-fluorophenyl)-N-[3-nitro-4-(2-pyridin-2-ylsulfanylethylamino)phenyl]sulfonyl-benzamide

Systemtic Name: 4-(4-fluorophenyl)-N-[3-nitro-4-(2-pyridin-2-ylsulfanylethylamino)phenyl]sulfonyl-benzamide Openeye Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[2-(2-pyridylsulfanyl)ethylamino]phenyl]sulfonyl-benzamide CAS Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[2-(2-pyridinylthio)ethylamino]phenyl]sulfonylbenzamide IUPAC Name: 4-(4-fluorophenyl)-N-[3-nitro-4-(2-pyridin-2-ylsulfanylethylamino)phenyl]sulfonylbenzamide Traditional Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[2-(2-pyridylthio)ethylamino]phenyl]sulfonyl-benzamide Formula: C26H21FN4O5S2 MolecularWeight: 552.597143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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