ethyl 2-(diethylcarbamothioylamino)-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(diethylcarbamothioylamino)-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(diethylcarbamothioylamino)benzothiophene-3-carboxylate CAS Name: 2-[[diethylamino(sulfanylidene)methyl]amino]-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(diethylcarbamothioylamino)-1-benzothiophene-3-carboxylate Traditional Name: 2-(diethylthiocarbamoylamino)benzothiophene-3-carboxylic acid ethyl ester Formula: C16H20N2O2S2 MolecularWeight: 336.4722

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O2S2/c1-4-18(5-2)16(21)17-14-13(15(19)20-6-3)11-9-7-8-10-12(11)22-14/h7-10H,4-6H2,1-3H3,(H,17,21)