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

Systemtic Name: N-[(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Openeye Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]propanamide CAS Name: N-[[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Traditional Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)thiocarbamoyl]propionamide Formula: C12H12ClN3OS2 MolecularWeight: 313.82618

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=NC2=C(S1)C=C(C(=C2)Cl)C

Isomeric SMILES

CCC(=O)NC(=S)NC1=NC2=C(S1)C=C(C(=C2)Cl)C

InChI

InChI=1S/C12H12ClN3OS2/c1-3-10(17)15-11(18)16-12-14-8-5-7(13)6(2)4-9(8)19-12/h4-5H,3H2,1-2H3,(H2,14,15,16,17,18)