3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluorophenyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluorophenyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluorophenyl)propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-fluorophenyl)propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(3-fluorophenyl)propanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(3-fluorophenyl)propionamide Formula: C16H13FN2OS2 MolecularWeight: 332.415623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SCCC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SCCC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C16H13FN2OS2/c17-11-4-3-5-12(10-11)18-15(20)8-9-21-16-19-13-6-1-2-7-14(13)22-16/h1-7,10H,8-9H2,(H,18,20)