N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)pentanamide

Systemtic Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)pentanamide Openeye Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)pentanamide CAS Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]pentanamide IUPAC Name: N-(6-methylsulfanyl-1,3-benzothiazol-2-yl)pentanamide Traditional Name: N-[6-(methylthio)-1,3-benzothiazol-2-yl]valeramide Formula: C13H16N2OS2 MolecularWeight: 280.40894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=NC2=C(S1)C=C(C=C2)SC

Isomeric SMILES

CCCCC(=O)NC1=NC2=C(S1)C=C(C=C2)SC

InChI

InChI=1S/C13H16N2OS2/c1-3-4-5-12(16)15-13-14-10-7-6-9(17-2)8-11(10)18-13/h6-8H,3-5H2,1-2H3,(H,14,15,16)