N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-propanamide

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-propanamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfanyl-propanamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(methylthio)propanamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-methylsulfanylpropanamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(methylthio)propionamide Formula: C13H16N2OS2 MolecularWeight: 280.40894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCSC)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)CCSC)C

InChI

InChI=1S/C13H16N2OS2/c1-8-6-9(2)12-10(7-8)18-13(15-12)14-11(16)4-5-17-3/h6-7H,4-5H2,1-3H3,(H,14,15,16)