N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(4-methoxy-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(4-methoxy-1,3-benzothiazol-2-yl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(4-methoxy-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(benzylthio)-N-(4-methoxy-1,3-benzothiazol-2-yl)acetamide Formula: C17H16N2O2S2 MolecularWeight: 344.45114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC=C1)SC(=N2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

COC1=C2C(=CC=C1)SC(=N2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C17H16N2O2S2/c1-21-13-8-5-9-14-16(13)19-17(23-14)18-15(20)11-22-10-12-6-3-2-4-7-12/h2-9H,10-11H2,1H3,(H,18,19,20)