(2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-(1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-[(5Z)-5-[(4-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]-3-(1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-(1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-[(5Z)-5-(4-bromobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-3-(1H-indol-3-yl)propionic acid Formula: C21H15BrN2O3S2 MolecularWeight: 487.3894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)N3C(=O)C(=CC4=CC=C(C=C4)Br)SC3=S

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N3C(=O)/C(=C/C4=CC=C(C=C4)Br)/SC3=S

InChI

InChI=1S/C21H15BrN2O3S2/c22-14-7-5-12(6-8-14)9-18-19(25)24(21(28)29-18)17(20(26)27)10-13-11-23-16-4-2-1-3-15(13)16/h1-9,11,17,23H,10H2,(H,26,27)/b18-9-/t17-/m0/s1