2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]ethanamide Openeye Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]acetamide CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[2-(cyanomethylthio)phenyl]acetamide IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[2-(cyanomethylsulfanyl)phenyl]acetamide Traditional Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-[2-(cyanomethylthio)phenyl]acetamide Formula: C19H18N4OS2 MolecularWeight: 382.50242

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

CN(CC1=NC2=CC=CC=C2S1)CC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C19H18N4OS2/c1-23(13-19-22-15-7-3-5-9-17(15)26-19)12-18(24)21-14-6-2-4-8-16(14)25-11-10-20/h2-9H,11-13H2,1H3,(H,21,24)