[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate

Systemtic Name: [2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate Openeye Name: [2-(3-fluoro-4-methyl-anilino)-2-oxo-ethyl] 4-(4-chlorophenyl)sulfanylbutanoate CAS Name: 4-[(4-chlorophenyl)thio]butanoic acid [2-(3-fluoro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-fluoro-4-methylanilino)-2-oxoethyl] 4-(4-chlorophenyl)sulfanylbutanoate Traditional Name: 4-[(4-chlorophenyl)thio]butyric acid [2-(3-fluoro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C19H19ClFNO3S MolecularWeight: 395.875463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCCSC2=CC=C(C=C2)Cl)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)CCCSC2=CC=C(C=C2)Cl)F

InChI

InChI=1S/C19H19ClFNO3S/c1-13-4-7-15(11-17(13)21)22-18(23)12-25-19(24)3-2-10-26-16-8-5-14(20)6-9-16/h4-9,11H,2-3,10,12H2,1H3,(H,22,23)