ethyl 2-(diethylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(diethylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(diethylcarbamothioylamino)-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[diethylamino(sulfanylidene)methyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(diethylcarbamothioylamino)-4-phenylthiophene-3-carboxylate Traditional Name: 2-(diethylthiocarbamoylamino)-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCN(CC)C(=S)NC1=C(C(=CS1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C18H22N2O2S2/c1-4-20(5-2)18(23)19-16-15(17(21)22-6-3)14(12-24-16)13-10-8-7-9-11-13/h7-12H,4-6H2,1-3H3,(H,19,23)