N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[(4,5-dichloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[(4,5-dichloro-1,3-benzothiazol-2-yl)thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C13H13Cl2N3OS2 MolecularWeight: 362.29782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC(=S)NC1=NC2=C(S1)C=CC(=C2Cl)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC(=S)NC1=NC2=C(S1)C=CC(=C2Cl)Cl

InChI

InChI=1S/C13H13Cl2N3OS2/c1-13(2,3)10(19)17-11(20)18-12-16-9-7(21-12)5-4-6(14)8(9)15/h4-5H,1-3H3,(H2,16,17,18,19,20)