N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-[(4-fluorophenyl)sulfonylamino]benzamide Formula: C23H20FN3O3S2 MolecularWeight: 469.551603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C23H20FN3O3S2/c24-19-9-11-20(12-10-19)32(29,30)27-22-8-4-3-7-21(22)23(28)26-13-14-31-16-18-6-2-1-5-17(18)15-25/h1-12,27H,13-14,16H2,(H,26,28)