N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[(5-chloranyl-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide Openeye Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide CAS Name: N-[[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methylpropanamide Traditional Name: N-[(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-methyl-propionamide Formula: C13H14ClN3O2S2 MolecularWeight: 343.85216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=NC2=CC(=C(C=C2S1)OC)Cl

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=NC2=CC(=C(C=C2S1)OC)Cl

InChI

InChI=1S/C13H14ClN3O2S2/c1-6(2)11(18)16-12(20)17-13-15-8-4-7(14)9(19-3)5-10(8)21-13/h4-6H,1-3H3,(H2,15,16,17,18,20)