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

Systemtic Name: N-[(6-chloranyl-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Openeye Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]propanamide CAS Name: N-[[(6-chloro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[(6-chloro-1,3-benzothiazol-2-yl)carbamothioyl]propanamide Traditional Name: N-[(6-chloro-1,3-benzothiazol-2-yl)thiocarbamoyl]propionamide Formula: C11H10ClN3OS2 MolecularWeight: 299.7996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10ClN3OS2/c1-2-9(16)14-10(17)15-11-13-7-4-3-6(12)5-8(7)18-11/h3-5H,2H2,1H3,(H2,13,14,15,16,17)