3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloro-6-fluoro-phenyl)methyl]propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-[(2-chloro-6-fluorophenyl)methyl]-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloro-6-fluorophenyl)methyl]propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(2-chloro-6-fluoro-benzyl)propane-1-sulfonamide Formula: C17H16ClFN2O2S3 MolecularWeight: 430.967543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCCCS(=O)(=O)NCC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCCS(=O)(=O)NCC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H16ClFN2O2S3/c18-13-5-3-6-14(19)12(13)11-20-26(22,23)10-4-9-24-17-21-15-7-1-2-8-16(15)25-17/h1-3,5-8,20H,4,9-11H2