[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C22H24FNO4S MolecularWeight: 417.493663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OCCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C22H24FNO4S/c1-15(2)24-21(26)14-29-20-8-4-3-6-18(20)22(27)28-13-5-7-19(25)16-9-11-17(23)12-10-16/h3-4,6,8-12,15H,5,7,13-14H2,1-2H3,(H,24,26)