cyclohexylazanium; 2-[3-methyl-4-oxidanylidene-2-(4-propan-2-ylphenyl)imino-1,3-thiazolidin-5-yl]ethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)[O-])C.C1CCC(CC1)[NH3+]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N=C2N(C(=O)C(S2)CC(=O)[O-])C.C1CCC(CC1)[NH3+]

InChI

InChI=1S/C15H18N2O3S.C6H13N/c1-9(2)10-4-6-11(7-5-10)16-15-17(3)14(20)12(21-15)8-13(18)19;7-6-4-2-1-3-5-6/h4-7,9,12H,8H2,1-3H3,(H,18,19);6H,1-5,7H2