(2S)-2-[[4-(5-bromanyl-2-dibenzofuran-4-yl-1,3-thiazol-4-yl)phenyl]sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[4-(5-bromanyl-2-dibenzofuran-4-yl-1,3-thiazol-4-yl)phenyl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[4-(5-bromo-2-dibenzofuran-4-yl-thiazol-4-yl)phenyl]sulfonylamino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[4-[5-bromo-2-(4-dibenzofuranyl)-4-thiazolyl]phenyl]sulfonylamino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[4-(5-bromo-2-dibenzofuran-4-yl-1,3-thiazol-4-yl)phenyl]sulfonylamino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[4-(5-bromo-2-dibenzofuran-4-yl-thiazol-4-yl)phenyl]sulfonylamino]-3-phenyl-propionic acid Formula: C30H21BrN2O5S2 MolecularWeight: 633.53214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=C(SC(=N3)C4=CC=CC5=C4OC6=CC=CC=C56)Br

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)C3=C(SC(=N3)C4=CC=CC5=C4OC6=CC=CC=C56)Br

InChI

InChI=1S/C30H21BrN2O5S2/c31-28-26(32-29(39-28)23-11-6-10-22-21-9-4-5-12-25(21)38-27(22)23)19-13-15-20(16-14-19)40(36,37)33-24(30(34)35)17-18-7-2-1-3-8-18/h1-16,24,33H,17H2,(H,34,35)/t24-/m0/s1