3-chloranyl-N-(propan-2-ylcarbamothioyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(propan-2-ylcarbamothioyl)-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(isopropylcarbamothioyl)benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(propan-2-ylamino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(propan-2-ylcarbamothioyl)-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(isopropylthiocarbamoyl)benzothiophene-2-carboxamide Formula: C13H13ClN2OS2 MolecularWeight: 312.83812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN2OS2/c1-7(2)15-13(18)16-12(17)11-10(14)8-5-3-4-6-9(8)19-11/h3-7H,1-2H3,(H2,15,16,17,18)