(2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoic acid

Systemtic Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoic acid Openeye Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoic acid CAS Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-phenylpropanoic acid IUPAC Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid Traditional Name: (2R)-2-[(5E)-5-(1H-benzimidazol-2-ylmethylene)-4-keto-2-thioxo-thiazolidin-3-yl]-3-phenyl-propionic acid Formula: C20H15N3O3S2 MolecularWeight: 409.4814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C(=CC3=NC4=CC=CC=C4N3)SC2=S

Isomeric SMILES

C1=CC=C(C=C1)C[C@H](C(=O)O)N2C(=O)/C(=C\C3=NC4=CC=CC=C4N3)/SC2=S

InChI

InChI=1S/C20H15N3O3S2/c24-18-16(11-17-21-13-8-4-5-9-14(13)22-17)28-20(27)23(18)15(19(25)26)10-12-6-2-1-3-7-12/h1-9,11,15H,10H2,(H,21,22)(H,25,26)/b16-11+/t15-/m1/s1