2-[2-(3-chloranyl-4-fluoranyl-phenyl)imino-3-ethyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoic acid; cyclohexanamine

Systemtic Name: 2-[2-(3-chloranyl-4-fluoranyl-phenyl)imino-3-ethyl-4-oxidanylidene-1,3-thiazolidin-5-yl]ethanoic acid; cyclohexanamine Openeye Name: 2-[2-(3-chloro-4-fluoro-phenyl)imino-3-ethyl-4-oxo-thiazolidin-5-yl]acetic acid; cyclohexanamine CAS Name: 2-[2-(3-chloro-4-fluorophenyl)imino-3-ethyl-4-oxo-5-thiazolidinyl]acetic acid; cyclohexanamine IUPAC Name: 2-[2-(3-chloro-4-fluorophenyl)imino-3-ethyl-4-oxo-1,3-thiazolidin-5-yl]acetic acid; cyclohexanamine Traditional Name: 2-[2-(3-chloro-4-fluoro-phenyl)imino-3-ethyl-4-keto-thiazolidin-5-yl]acetic acid; cyclohexylamine Formula: C19H25ClFN3O3S MolecularWeight: 429.936503

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(SC1=NC2=CC(=C(C=C2)F)Cl)CC(=O)O.C1CCC(CC1)N

Isomeric SMILES

CCN1C(=O)C(SC1=NC2=CC(=C(C=C2)F)Cl)CC(=O)O.C1CCC(CC1)N

InChI

InChI=1S/C13H12ClFN2O3S.C6H13N/c1-2-17-12(20)10(6-11(18)19)21-13(17)16-7-3-4-9(15)8(14)5-7;7-6-4-2-1-3-5-6/h3-5,10H,2,6H2,1H3,(H,18,19);6H,1-5,7H2