3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]propane-1-sulfonamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]propane-1-sulfonamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloro-4-fluoro-phenyl)methyl]propane-1-sulfonamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-[(2-chloro-4-fluorophenyl)methyl]-1-propanesulfonamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-chloro-4-fluorophenyl)methyl]propane-1-sulfonamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(2-chloro-4-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=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCCS(=O)(=O)NCC3=C(C=C(C=C3)F)Cl

InChI

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