4-(4-fluorophenyl)-N-[3-nitro-4-[(2-phenylsulfanylcyclohexyl)amino]phenyl]sulfonyl-benzamide

Systemtic Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[(2-phenylsulfanylcyclohexyl)amino]phenyl]sulfonyl-benzamide Openeye Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[(2-phenylsulfanylcyclohexyl)amino]phenyl]sulfonyl-benzamide CAS Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[[2-(phenylthio)cyclohexyl]amino]phenyl]sulfonylbenzamide IUPAC Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[(2-phenylsulfanylcyclohexyl)amino]phenyl]sulfonylbenzamide Traditional Name: 4-(4-fluorophenyl)-N-[3-nitro-4-[[2-(phenylthio)cyclohexyl]amino]phenyl]sulfonyl-benzamide Formula: C31H28FN3O5S2 MolecularWeight: 605.699523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)NC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-])SC5=CC=CC=C5

Isomeric SMILES

C1CCC(C(C1)NC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-])SC5=CC=CC=C5

InChI

InChI=1S/C31H28FN3O5S2/c32-24-16-14-22(15-17-24)21-10-12-23(13-11-21)31(36)34-42(39,40)26-18-19-27(29(20-26)35(37)38)33-28-8-4-5-9-30(28)41-25-6-2-1-3-7-25/h1-3,6-7,10-20,28,30,33H,4-5,8-9H2,(H,34,36)