3,6-bis(chloranyl)-N-(4,5-dihydro-1,3-thiazol-2-ylcarbamothioyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-(4,5-dihydro-1,3-thiazol-2-ylcarbamothioyl)-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-(4,5-dihydrothiazol-2-ylcarbamothioyl)benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(4,5-dihydrothiazol-2-ylamino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-(4,5-dihydro-1,3-thiazol-2-ylcarbamothioyl)-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-(2-thiazolin-2-ylthiocarbamoyl)benzothiophene-2-carboxamide Formula: C13H9Cl2N3OS3 MolecularWeight: 390.33106

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=N1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CSC(=N1)NC(=S)NC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C13H9Cl2N3OS3/c14-6-1-2-7-8(5-6)22-10(9(7)15)11(19)17-12(20)18-13-16-3-4-21-13/h1-2,5H,3-4H2,(H2,16,17,18,19,20)