ethyl 2-[2-(3-ethanoyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(3-ethanoyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)ethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-acetyl-5-oxo-2-thioxo-imidazolidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-(3-acetyl-5-oxo-2-sulfanylidene-1-imidazolidinyl)-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-acetyl-5-oxo-2-sulfanylideneimidazolidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(3-acetyl-5-keto-2-thioxo-imidazolidin-1-yl)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C18H21N3O5S2 MolecularWeight: 423.50644

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C(=O)CN(C3=S)C(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C(=O)CN(C3=S)C(=O)C

InChI

InChI=1S/C18H21N3O5S2/c1-3-26-17(25)15-11-6-4-5-7-12(11)28-16(15)19-13(23)8-21-14(24)9-20(10(2)22)18(21)27/h3-9H2,1-2H3,(H,19,23)