ethyl 4-[[2-[(5-fluoranyl-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-[(5-fluoranyl-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate Openeye Name: ethyl 4-[[2-[(5-fluoro-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoate CAS Name: 4-[[2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-1-oxo-3-phenylpropyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(5-fluoro-2-methoxyphenyl)sulfonylamino]-3-phenylpropanoyl]amino]benzoate Traditional Name: 4-[[2-[(5-fluoro-2-methoxy-phenyl)sulfonylamino]-3-phenyl-propanoyl]amino]benzoic acid ethyl ester Formula: C25H25FN2O6S MolecularWeight: 500.539203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)F)OC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(CC2=CC=CC=C2)NS(=O)(=O)C3=C(C=CC(=C3)F)OC

InChI

InChI=1S/C25H25FN2O6S/c1-3-34-25(30)18-9-12-20(13-10-18)27-24(29)21(15-17-7-5-4-6-8-17)28-35(31,32)23-16-19(26)11-14-22(23)33-2/h4-14,16,21,28H,3,15H2,1-2H3,(H,27,29)