[2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-(4-methylpiperidin-1-yl)carbothioylsulfanylethanoate

Systemtic Name: [2-[(2-fluorophenyl)methylamino]-2-oxidanylidene-ethyl] 2-(4-methylpiperidin-1-yl)carbothioylsulfanylethanoate Openeye Name: [2-[(2-fluorophenyl)methylamino]-2-oxo-ethyl] 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetate CAS Name: 2-[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]thio]acetic acid [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)methylamino]-2-oxoethyl] 2-(4-methylpiperidine-1-carbothioyl)sulfanylacetate Traditional Name: 2-[(4-methylpiperidine-1-carbothioyl)thio]acetic acid [2-[(2-fluorobenzyl)amino]-2-keto-ethyl] ester Formula: C18H23FN2O3S2 MolecularWeight: 398.515223

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)SCC(=O)OCC(=O)NCC2=CC=CC=C2F

Isomeric SMILES

CC1CCN(CC1)C(=S)SCC(=O)OCC(=O)NCC2=CC=CC=C2F

InChI

InChI=1S/C18H23FN2O3S2/c1-13-6-8-21(9-7-13)18(25)26-12-17(23)24-11-16(22)20-10-14-4-2-3-5-15(14)19/h2-5,13H,6-12H2,1H3,(H,20,22)