methyl 3-chloranyl-6-(formamidocarbamothioylamino)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-(formamidocarbamothioylamino)-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-(formamidocarbamothioylamino)benzothiophene-2-carboxylate CAS Name: 3-chloro-6-[[(formylhydrazo)-sulfanylidenemethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-(formamidocarbamothioylamino)-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-(formamidothiocarbamoylamino)benzothiophene-2-carboxylic acid methyl ester Formula: C12H10ClN3O3S2 MolecularWeight: 343.8091

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NNC=O)Cl

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NNC=O)Cl

InChI

InChI=1S/C12H10ClN3O3S2/c1-19-11(18)10-9(13)7-3-2-6(4-8(7)21-10)15-12(20)16-14-5-17/h2-5H,1H3,(H,14,17)(H2,15,16,20)