N-[1-(1-benzofuran-2-yl)ethyl]-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methyl-ethanamide

Systemtic Name: N-[1-(1-benzofuran-2-yl)ethyl]-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methyl-ethanamide Openeye Name: N-[1-(benzofuran-2-yl)ethyl]-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methyl-acetamide CAS Name: N-[1-(2-benzofuranyl)ethyl]-2-(1,3-benzothiazol-2-ylmethylthio)-N-methylacetamide IUPAC Name: N-[1-(1-benzofuran-2-yl)ethyl]-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-N-methylacetamide Traditional Name: N-[1-(benzofuran-2-yl)ethyl]-2-(1,3-benzothiazol-2-ylmethylthio)-N-methyl-acetamide Formula: C21H20N2O2S2 MolecularWeight: 396.5257

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2O1)N(C)C(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C1=CC2=CC=CC=C2O1)N(C)C(=O)CSCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2O2S2/c1-14(18-11-15-7-3-5-9-17(15)25-18)23(2)21(24)13-26-12-20-22-16-8-4-6-10-19(16)27-20/h3-11,14H,12-13H2,1-2H3