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

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(benzylthio)-N-(4-methyl-1,3-benzothiazol-2-yl)acetamide Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CSCC3=CC=CC=C3

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CSCC3=CC=CC=C3

InChI

InChI=1S/C17H16N2OS2/c1-12-6-5-9-14-16(12)19-17(22-14)18-15(20)11-21-10-13-7-3-2-4-8-13/h2-9H,10-11H2,1H3,(H,18,19,20)