ethyl 3-(2-azanyl-5-phenoxy-phenyl)sulfanyl-3-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanyl-propanoate

Systemtic Name: ethyl 3-(2-azanyl-5-phenoxy-phenyl)sulfanyl-3-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanyl-propanoate Openeye Name: ethyl 3-(2-amino-5-phenoxy-phenyl)sulfanyl-3-(3-fluoro-4-methoxy-phenyl)-2-hydroxy-propanoate CAS Name: 3-[(2-amino-5-phenoxyphenyl)thio]-3-(3-fluoro-4-methoxyphenyl)-2-hydroxypropanoic acid ethyl ester IUPAC Name: ethyl 3-(2-amino-5-phenoxyphenyl)sulfanyl-3-(3-fluoro-4-methoxyphenyl)-2-hydroxypropanoate Traditional Name: 3-[(2-amino-5-phenoxy-phenyl)thio]-3-(3-fluoro-4-methoxy-phenyl)-2-hydroxy-propionic acid ethyl ester Formula: C24H24FNO5S MolecularWeight: 457.514463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC(=C(C=C1)OC)F)SC2=C(C=CC(=C2)OC3=CC=CC=C3)N)O

Isomeric SMILES

CCOC(=O)C(C(C1=CC(=C(C=C1)OC)F)SC2=C(C=CC(=C2)OC3=CC=CC=C3)N)O

InChI

InChI=1S/C24H24FNO5S/c1-3-30-24(28)22(27)23(15-9-12-20(29-2)18(25)13-15)32-21-14-17(10-11-19(21)26)31-16-7-5-4-6-8-16/h4-14,22-23,27H,3,26H2,1-2H3