2-(diethylcarbamothioylamino)-4-propan-2-yl-thiophene-3-carboxylic acid

Systemtic Name: 2-(diethylcarbamothioylamino)-4-propan-2-yl-thiophene-3-carboxylic acid Openeye Name: 2-(diethylcarbamothioylamino)-4-isopropyl-thiophene-3-carboxylic acid CAS Name: 2-[[diethylamino(sulfanylidene)methyl]amino]-4-propan-2-yl-3-thiophenecarboxylic acid IUPAC Name: 2-(diethylcarbamothioylamino)-4-propan-2-ylthiophene-3-carboxylic acid Traditional Name: 2-(diethylthiocarbamoylamino)-4-isopropyl-3-thenoic acid Formula: C13H20N2O2S2 MolecularWeight: 300.4401

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NC1=C(C(=CS1)C(C)C)C(=O)O

Isomeric SMILES

CCN(CC)C(=S)NC1=C(C(=CS1)C(C)C)C(=O)O

InChI

InChI=1S/C13H20N2O2S2/c1-5-15(6-2)13(18)14-11-10(12(16)17)9(7-19-11)8(3)4/h7-8H,5-6H2,1-4H3,(H,14,18)(H,16,17)