N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-fluoranyl-benzamide Openeye Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-fluoro-benzamide CAS Name: N-[2-[(3,4-dichlorophenyl)methylthio]-1,3-benzothiazol-6-yl]-2-fluorobenzamide IUPAC Name: N-[2-[(3,4-dichlorophenyl)methylsulfanyl]-1,3-benzothiazol-6-yl]-2-fluorobenzamide Traditional Name: N-[2-[(3,4-dichlorobenzyl)thio]-1,3-benzothiazol-6-yl]-2-fluoro-benzamide Formula: C21H13Cl2FN2OS2 MolecularWeight: 463.375123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC(=C(C=C4)Cl)Cl)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC4=CC(=C(C=C4)Cl)Cl)F

InChI

InChI=1S/C21H13Cl2FN2OS2/c22-15-7-5-12(9-16(15)23)11-28-21-26-18-8-6-13(10-19(18)29-21)25-20(27)14-3-1-2-4-17(14)24/h1-10H,11H2,(H,25,27)