4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-fluorophenyl)methyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-fluorophenyl)methyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-fluorophenyl)methyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-[(2-fluorophenyl)methyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-[(2-fluorophenyl)methyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(2-fluorobenzyl)butyramide Formula: C18H17FN2OS2 MolecularWeight: 360.468783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)CCCSC2=NC3=CC=CC=C3S2)F

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)CCCSC2=NC3=CC=CC=C3S2)F

InChI

InChI=1S/C18H17FN2OS2/c19-14-7-2-1-6-13(14)12-20-17(22)10-5-11-23-18-21-15-8-3-4-9-16(15)24-18/h1-4,6-9H,5,10-12H2,(H,20,22)