ethyl 4-[2-(1-ethyl-3-heptyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-(1-ethyl-3-heptyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(1-ethyl-3-heptyl-5-oxo-2-thioxo-imidazolidin-4-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(1-ethyl-3-heptyl-5-oxo-2-sulfanylidene-4-imidazolidinyl)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1-ethyl-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(1-ethyl-3-heptyl-5-keto-2-thioxo-imidazolidin-4-yl)acetyl]amino]benzoic acid ethyl ester Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(C(=O)N(C1=S)CC)CC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCCCCN1C(C(=O)N(C1=S)CC)CC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C23H33N3O4S/c1-4-7-8-9-10-15-26-19(21(28)25(5-2)23(26)31)16-20(27)24-18-13-11-17(12-14-18)22(29)30-6-3/h11-14,19H,4-10,15-16H2,1-3H3,(H,24,27)