4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-fluoranyl-2-methyl-phenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-fluoranyl-2-methyl-phenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-fluoro-2-methyl-phenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-ylthio)-N-(5-fluoro-2-methylphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-N-(5-fluoro-2-methylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-N-(5-fluoro-2-methyl-phenyl)butyramide Formula: C18H17FN2OS2 MolecularWeight: 360.468783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)NC(=O)CCCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=C(C=C1)F)NC(=O)CCCSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17FN2OS2/c1-12-8-9-13(19)11-15(12)20-17(22)7-4-10-23-18-21-14-5-2-3-6-16(14)24-18/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,20,22)