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

Systemtic Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-methylsulfanyl-propanamide Openeye Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-methylsulfanyl-propanamide CAS Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(methylthio)propanamide IUPAC Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-methylsulfanylpropanamide Traditional Name: N-(2-methyl-1,3-benzothiazol-6-yl)-3-(methylthio)propionamide Formula: C12H14N2OS2 MolecularWeight: 266.38236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCSC

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCSC

InChI

InChI=1S/C12H14N2OS2/c1-8-13-10-4-3-9(7-11(10)17-8)14-12(15)5-6-16-2/h3-4,7H,5-6H2,1-2H3,(H,14,15)