2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylthio)acetyl]-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C19H19N3O2S3 MolecularWeight: 417.56806

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O2S3/c1-22(11-17(23)20-13-7-3-5-9-15(13)25-2)18(24)12-26-19-21-14-8-4-6-10-16(14)27-19/h3-10H,11-12H2,1-2H3,(H,20,23)