cyclohexylazanium; 2-[3-ethyl-4-oxidanylidene-2-(4-phenoxyphenyl)imino-1,3-thiazolidin-5-yl]ethanoate

Systemtic Name: cyclohexylazanium; 2-[3-ethyl-4-oxidanylidene-2-(4-phenoxyphenyl)imino-1,3-thiazolidin-5-yl]ethanoate Openeye Name: cyclohexylammonium; 2-[3-ethyl-4-oxo-2-(4-phenoxyphenyl)imino-thiazolidin-5-yl]acetate CAS Name: cyclohexylammonium; 2-[3-ethyl-4-oxo-2-(4-phenoxyphenyl)imino-5-thiazolidinyl]acetate IUPAC Name: cyclohexylazanium; 2-[3-ethyl-4-oxo-2-(4-phenoxyphenyl)imino-1,3-thiazolidin-5-yl]acetate Traditional Name: cyclohexylammonium; 2-[3-ethyl-4-keto-2-(4-phenoxyphenyl)imino-thiazolidin-5-yl]acetate Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(SC1=NC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=O)[O-].C1CCC(CC1)[NH3+]

Isomeric SMILES

CCN1C(=O)C(SC1=NC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=O)[O-].C1CCC(CC1)[NH3+]

InChI

InChI=1S/C19H18N2O4S.C6H13N/c1-2-21-18(24)16(12-17(22)23)26-19(21)20-13-8-10-15(11-9-13)25-14-6-4-3-5-7-14;7-6-4-2-1-3-5-6/h3-11,16H,2,12H2,1H3,(H,22,23);6H,1-5,7H2