ethyl 4-[2-[3-[(4-fluorophenyl)carbonylamino]phenyl]sulfanylethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[3-[(4-fluorophenyl)carbonylamino]phenyl]sulfanylethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[3-[(4-fluorobenzoyl)amino]phenyl]sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[[3-[[(4-fluorophenyl)-oxomethyl]amino]phenyl]thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[3-[(4-fluorobenzoyl)amino]phenyl]sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[[3-[(4-fluorobenzoyl)amino]phenyl]thio]acetyl]amino]benzoic acid ethyl ester Formula: C24H21FN2O4S MolecularWeight: 452.497943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H21FN2O4S/c1-2-31-24(30)17-8-12-19(13-9-17)26-22(28)15-32-21-5-3-4-20(14-21)27-23(29)16-6-10-18(25)11-7-16/h3-14H,2,15H2,1H3,(H,26,28)(H,27,29)