2-[(4S)-3-[2-(1-adamantyl)ethyl]-1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-(4-propoxyphenyl)ethanamide

Systemtic Name: 2-[(4S)-3-[2-(1-adamantyl)ethyl]-1-ethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl]-N-(4-propoxyphenyl)ethanamide Openeye Name: 2-[(4S)-3-[2-(1-adamantyl)ethyl]-1-ethyl-5-oxo-2-thioxo-imidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide CAS Name: 2-[(4S)-3-[2-(1-adamantyl)ethyl]-1-ethyl-5-oxo-2-sulfanylidene-4-imidazolidinyl]-N-(4-propoxyphenyl)acetamide IUPAC Name: 2-[(4S)-3-[2-(1-adamantyl)ethyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide Traditional Name: 2-[(4S)-3-[2-(1-adamantyl)ethyl]-1-ethyl-5-keto-2-thioxo-imidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide Formula: C28H39N3O3S MolecularWeight: 497.69256

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)NC(=O)CC2C(=O)N(C(=S)N2CCC34CC5CC(C3)CC(C5)C4)CC

Isomeric SMILES

CCCOC1=CC=C(C=C1)NC(=O)C[C@H]2C(=O)N(C(=S)N2CCC34CC5CC(C3)CC(C5)C4)CC

InChI

InChI=1S/C28H39N3O3S/c1-3-11-34-23-7-5-22(6-8-23)29-25(32)15-24-26(33)30(4-2)27(35)31(24)10-9-28-16-19-12-20(17-28)14-21(13-19)18-28/h5-8,19-21,24H,3-4,9-18H2,1-2H3,(H,29,32)/t19?,20?,21?,24-,28?/m0/s1