3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-ethylhexyl)butanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-ethylhexyl)butanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-ethylhexyl)butanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-(2-ethylhexyl)butanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-ethylhexyl)butanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-(2-ethylhexyl)butyramide Formula: C19H28N2OS2 MolecularWeight: 364.56842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=O)CC(C)SC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCCCC(CC)CNC(=O)CC(C)SC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C19H28N2OS2/c1-4-6-9-15(5-2)13-20-18(22)12-14(3)23-19-21-16-10-7-8-11-17(16)24-19/h7-8,10-11,14-15H,4-6,9,12-13H2,1-3H3,(H,20,22)