2-[(5E)-5-(3-ethyl-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-3-phenyl-2-sulfanylidene-imidazolidin-1-yl]ethanoic acid

Systemtic Name: 2-[(5E)-5-(3-ethyl-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-3-phenyl-2-sulfanylidene-imidazolidin-1-yl]ethanoic acid Openeye Name: 2-[(5E)-5-(3-ethyl-1,3-benzoxazol-2-ylidene)-4-oxo-3-phenyl-2-thioxo-imidazolidin-1-yl]acetic acid CAS Name: 2-[(5E)-5-(3-ethyl-1,3-benzoxazol-2-ylidene)-4-oxo-3-phenyl-2-sulfanylidene-1-imidazolidinyl]acetic acid IUPAC Name: 2-[(5E)-5-(3-ethyl-1,3-benzoxazol-2-ylidene)-4-oxo-3-phenyl-2-sulfanylideneimidazolidin-1-yl]acetic acid Traditional Name: 2-[(5E)-5-(3-ethyl-1,3-benzoxazol-2-ylidene)-4-keto-3-phenyl-2-thioxo-imidazolidin-1-yl]acetic acid Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2OC1=C3C(=O)N(C(=S)N3CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCN\1C2=CC=CC=C2O/C1=C/3\C(=O)N(C(=S)N3CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C20H17N3O4S/c1-2-21-14-10-6-7-11-15(14)27-19(21)17-18(26)23(13-8-4-3-5-9-13)20(28)22(17)12-16(24)25/h3-11H,2,12H2,1H3,(H,24,25)/b19-17+