2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-[methyl-(phenylmethyl)amino]propyl]ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-[benzyl(methyl)amino]propyl]acetamide CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[3-[methyl-(phenylmethyl)amino]propyl]acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-[3-[benzyl(methyl)amino]propyl]acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-N-[3-[benzyl(methyl)amino]propyl]acetamide Formula: C21H25N3OS2 MolecularWeight: 399.5727

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)CSCC1=NC2=CC=CC=C2S1)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)CSCC1=NC2=CC=CC=C2S1)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3OS2/c1-24(14-17-8-3-2-4-9-17)13-7-12-22-20(25)15-26-16-21-23-18-10-5-6-11-19(18)27-21/h2-6,8-11H,7,12-16H2,1H3,(H,22,25)