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

Systemtic Name: ethyl 4-[2-[1-(3-chlorophenyl)-3-heptyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[1-(3-chlorophenyl)-3-heptyl-5-oxo-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[1-(3-chlorophenyl)-3-heptyl-5-oxo-2-sulfanylidene-4-imidazolidinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-(3-chlorophenyl)-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[1-(3-chlorophenyl)-3-heptyl-5-keto-2-thioxo-imidazolidin-4-yl]acetyl]amino]benzoic acid ethyl ester Formula: C27H32ClN3O4S MolecularWeight: 530.07868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(C(=O)N(C1=S)C2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CCCCCCCN1C(C(=O)N(C1=S)C2=CC(=CC=C2)Cl)CC(=O)NC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C27H32ClN3O4S/c1-3-5-6-7-8-16-30-23(25(33)31(27(30)36)22-11-9-10-20(28)17-22)18-24(32)29-21-14-12-19(13-15-21)26(34)35-4-2/h9-15,17,23H,3-8,16,18H2,1-2H3,(H,29,32)