propan-2-yl 4-[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]ethanoylamino]benzoate

Systemtic Name: propan-2-yl 4-[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]ethanoylamino]benzoate Openeye Name: isopropyl 4-[[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]acetyl]amino]benzoate CAS Name: 4-[[2-[3-[(4-fluorophenyl)thio]-1-oxopropoxy]-1-oxoethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[2-[3-(4-fluorophenyl)sulfanylpropanoyloxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[3-[(4-fluorophenyl)thio]propanoyloxy]acetyl]amino]benzoic acid isopropyl ester Formula: C21H22FNO5S MolecularWeight: 419.466483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22FNO5S/c1-14(2)28-21(26)15-3-7-17(8-4-15)23-19(24)13-27-20(25)11-12-29-18-9-5-16(22)6-10-18/h3-10,14H,11-13H2,1-2H3,(H,23,24)