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

Systemtic Name: cyclohexylazanium; 2-[2-(3,4-dimethylphenyl)imino-3-ethyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoate Openeye Name: cyclohexylammonium; 2-[2-(3,4-dimethylphenyl)imino-3-ethyl-4-oxo-thiazolidin-5-yl]acetate CAS Name: cyclohexylammonium; 2-[2-(3,4-dimethylphenyl)imino-3-ethyl-4-oxo-5-thiazolidinyl]acetate IUPAC Name: cyclohexylazanium; 2-[2-(3,4-dimethylphenyl)imino-3-ethyl-4-oxo-1,3-thiazolidin-5-yl]acetate Traditional Name: cyclohexylammonium; 2-[2-(3,4-dimethylphenyl)imino-3-ethyl-4-keto-thiazolidin-5-yl]acetate Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H18N2O3S.C6H13N/c1-4-17-14(20)12(8-13(18)19)21-15(17)16-11-6-5-9(2)10(3)7-11;7-6-4-2-1-3-5-6/h5-7,12H,4,8H2,1-3H3,(H,18,19);6H,1-5,7H2