4-[2-[4-(4-fluorophenyl)-5-phenyl-2-propan-2-yl-thiophen-3-yl]ethyl-oxidanyl-amino]-3-oxidanyl-butanoic acid hydrobromide

Systemtic Name: 4-[2-[4-(4-fluorophenyl)-5-phenyl-2-propan-2-yl-thiophen-3-yl]ethyl-oxidanyl-amino]-3-oxidanyl-butanoic acid hydrobromide Openeye Name: 4-[2-[4-(4-fluorophenyl)-2-isopropyl-5-phenyl-3-thienyl]ethyl-hydroxy-amino]-3-hydroxy-butanoic acid hydrobromide CAS Name: 4-[2-[4-(4-fluorophenyl)-5-phenyl-2-propan-2-yl-3-thiophenyl]ethyl-hydroxyamino]-3-hydroxybutanoic acid hydrobromide IUPAC Name: 4-[2-[4-(4-fluorophenyl)-5-phenyl-2-propan-2-ylthiophen-3-yl]ethyl-hydroxyamino]-3-hydroxybutanoic acid hydrobromide Traditional Name: 4-[2-[4-(4-fluorophenyl)-2-isopropyl-5-phenyl-3-thienyl]ethyl-hydroxy-amino]-3-hydroxy-butyric acid hydrobromide Formula: C25H29BrFNO4S MolecularWeight: 538.469463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=C(S1)C2=CC=CC=C2)C3=CC=C(C=C3)F)CCN(CC(CC(=O)O)O)O.Br

Isomeric SMILES

CC(C)C1=C(C(=C(S1)C2=CC=CC=C2)C3=CC=C(C=C3)F)CCN(CC(CC(=O)O)O)O.Br

InChI

InChI=1S/C25H28FNO4S.BrH/c1-16(2)24-21(12-13-27(31)15-20(28)14-22(29)30)23(17-8-10-19(26)11-9-17)25(32-24)18-6-4-3-5-7-18;/h3-11,16,20,28,31H,12-15H2,1-2H3,(H,29,30);1H