N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide

Systemtic Name: N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide Openeye Name: N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-4-(2-thienylsulfonylamino)benzamide CAS Name: N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide IUPAC Name: N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide Traditional Name: N-[2-[(2-chloro-6-fluoro-benzyl)thio]ethyl]-4-(2-thienylsulfonylamino)benzamide Formula: C20H18ClFN2O3S3 MolecularWeight: 485.014923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)F

InChI

InChI=1S/C20H18ClFN2O3S3/c21-17-3-1-4-18(22)16(17)13-28-12-10-23-20(25)14-6-8-15(9-7-14)24-30(26,27)19-5-2-11-29-19/h1-9,11,24H,10,12-13H2,(H,23,25)