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

Systemtic Name: N-[(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]butanamide Openeye Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]butanamide CAS Name: N-[[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]butanamide Traditional Name: N-[(5-chloro-6-methyl-1,3-benzothiazol-2-yl)thiocarbamoyl]butyramide Formula: C13H14ClN3OS2 MolecularWeight: 327.85276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClN3OS2/c1-3-4-11(18)16-12(19)17-13-15-9-6-8(14)7(2)5-10(9)20-13/h5-6H,3-4H2,1-2H3,(H2,15,16,17,18,19)