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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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