N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]carbamothioyl]-2-methyl-propanamide Openeye Name: N-[[(3-chlorobenzothiophene-2-carbonyl)amino]carbamothioyl]-2-methyl-propanamide CAS Name: N-[[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[[(3-chloro-1-benzothiophene-2-carbonyl)amino]carbamothioyl]-2-methylpropanamide Traditional Name: N-[[(3-chlorobenzothiophene-2-carbonyl)amino]thiocarbamoyl]-2-methyl-propionamide Formula: C14H14ClN3O2S2 MolecularWeight: 355.86286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NNC(=O)C1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(C)C(=O)NC(=S)NNC(=O)C1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C14H14ClN3O2S2/c1-7(2)12(19)16-14(21)18-17-13(20)11-10(15)8-5-3-4-6-9(8)22-11/h3-7H,1-2H3,(H,17,20)(H2,16,18,19,21)