[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate

Systemtic Name: [2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate Openeye Name: [2-(2,3-dimethylanilino)-2-oxo-ethyl] 3-(4-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(4-fluorophenyl)thio]propanoic acid [2-(2,3-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dimethylanilino)-2-oxoethyl] 3-(4-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-fluorophenyl)thio]propionic acid [2-(2,3-dimethylanilino)-2-keto-ethyl] ester Formula: C19H20FNO3S MolecularWeight: 361.430403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)COC(=O)CCSC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)COC(=O)CCSC2=CC=C(C=C2)F)C

InChI

InChI=1S/C19H20FNO3S/c1-13-4-3-5-17(14(13)2)21-18(22)12-24-19(23)10-11-25-16-8-6-15(20)7-9-16/h3-9H,10-12H2,1-2H3,(H,21,22)