2-[(5Z)-5-(5-chloranyl-1,3-dimethyl-benzimidazol-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoic acid

Systemtic Name: 2-[(5Z)-5-(5-chloranyl-1,3-dimethyl-benzimidazol-2-ylidene)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenyl-propanoic acid Openeye Name: 2-[(5Z)-5-(5-chloro-1,3-dimethyl-benzimidazol-2-ylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-3-phenyl-propanoic acid CAS Name: 2-[(5Z)-5-(5-chloro-1,3-dimethyl-2-benzimidazolylidene)-4-oxo-2-sulfanylidene-3-thiazolidinyl]-3-phenylpropanoic acid IUPAC Name: 2-[(5Z)-5-(5-chloro-1,3-dimethylbenzimidazol-2-ylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-3-phenylpropanoic acid Traditional Name: 2-[(5Z)-5-(5-chloro-1,3-dimethyl-benzimidazol-2-ylidene)-4-keto-2-thioxo-thiazolidin-3-yl]-3-phenyl-propionic acid Formula: C21H18ClN3O3S2 MolecularWeight: 459.96892

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)Cl)N(C1=C3C(=O)N(C(=S)S3)C(CC4=CC=CC=C4)C(=O)O)C

Isomeric SMILES

CN\1C2=C(C=C(C=C2)Cl)N(/C1=C\3/C(=O)N(C(=S)S3)C(CC4=CC=CC=C4)C(=O)O)C

InChI

InChI=1S/C21H18ClN3O3S2/c1-23-14-9-8-13(22)11-15(14)24(2)18(23)17-19(26)25(21(29)30-17)16(20(27)28)10-12-6-4-3-5-7-12/h3-9,11,16H,10H2,1-2H3,(H,27,28)/b18-17-