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

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(1-phenylethyl)butanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(1-phenylethyl)butanamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(1-phenylethyl)butanamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(1-phenylethyl)butanamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(1-phenylethyl)butyramide Formula: C19H20N2OS2 MolecularWeight: 356.5049

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C)C1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCC(C(=O)NC(C)C1=CC=CC=C1)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20N2OS2/c1-3-16(18(22)20-13(2)14-9-5-4-6-10-14)23-19-21-15-11-7-8-12-17(15)24-19/h4-13,16H,3H2,1-2H3,(H,20,22)