2-(3-cyclooctyl-4-oxidanylidene-2-prop-2-enylimino-1,3-thiazolidin-5-yl)-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-(3-cyclooctyl-4-oxidanylidene-2-prop-2-enylimino-1,3-thiazolidin-5-yl)-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(2-allylimino-3-cyclooctyl-4-oxo-thiazolidin-5-yl)-N-(2-nitrophenyl)acetamide CAS Name: 2-(3-cyclooctyl-4-oxo-2-prop-2-enylimino-5-thiazolidinyl)-N-(2-nitrophenyl)acetamide IUPAC Name: 2-(3-cyclooctyl-4-oxo-2-prop-2-enylimino-1,3-thiazolidin-5-yl)-N-(2-nitrophenyl)acetamide Traditional Name: 2-(2-allylimino-3-cyclooctyl-4-keto-thiazolidin-5-yl)-N-(2-nitrophenyl)acetamide Formula: C22H28N4O4S MolecularWeight: 444.54712

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN=C1N(C(=O)C(S1)CC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3CCCCCCC3

Isomeric SMILES

C=CCN=C1N(C(=O)C(S1)CC(=O)NC2=CC=CC=C2[N+](=O)[O-])C3CCCCCCC3

InChI

InChI=1S/C22H28N4O4S/c1-2-14-23-22-25(16-10-6-4-3-5-7-11-16)21(28)19(31-22)15-20(27)24-17-12-8-9-13-18(17)26(29)30/h2,8-9,12-13,16,19H,1,3-7,10-11,14-15H2,(H,24,27)