[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 2-(4-methylpiperidin-1-yl)carbothioylsulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl] 2-(4-methylpiperidin-1-yl)carbothioylsulfanylethanoate Openeye Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetate CAS Name: 2-[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]thio]acetic acid [2-oxo-2-(2,4,6-trimethylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,6-trimethylanilino)ethyl] 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetate Traditional Name: 2-[(4-methylpiperidine-1-carbothioyl)thio]acetic acid (2-keto-2-mesidino-ethyl) ester Formula: C20H28N2O3S2 MolecularWeight: 408.57792

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)SCC(=O)OCC(=O)NC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC1CCN(CC1)C(=S)SCC(=O)OCC(=O)NC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C20H28N2O3S2/c1-13-5-7-22(8-6-13)20(26)27-12-18(24)25-11-17(23)21-19-15(3)9-14(2)10-16(19)4/h9-10,13H,5-8,11-12H2,1-4H3,(H,21,23)