2-(diethylcarbamothioylamino)-1-benzothiophene-3-carboxylic acid

Systemtic Name: 2-(diethylcarbamothioylamino)-1-benzothiophene-3-carboxylic acid Openeye Name: 2-(diethylcarbamothioylamino)benzothiophene-3-carboxylic acid CAS Name: 2-[[diethylamino(sulfanylidene)methyl]amino]-1-benzothiophene-3-carboxylic acid IUPAC Name: 2-(diethylcarbamothioylamino)-1-benzothiophene-3-carboxylic acid Traditional Name: 2-(diethylthiocarbamoylamino)benzothiophene-3-carboxylic acid Formula: C14H16N2O2S2 MolecularWeight: 308.41904

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NC1=C(C2=CC=CC=C2S1)C(=O)O

Isomeric SMILES

CCN(CC)C(=S)NC1=C(C2=CC=CC=C2S1)C(=O)O

InChI

InChI=1S/C14H16N2O2S2/c1-3-16(4-2)14(19)15-12-11(13(17)18)9-7-5-6-8-10(9)20-12/h5-8H,3-4H2,1-2H3,(H,15,19)(H,17,18)