4-azanyl-4-oxidanylidene-2-[[(2E)-2-(5-oxidanyl-3-oxidanylidene-4-phenyl-thiophen-2-ylidene)-2-phenyl-ethanoyl]amino]butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-[[(2E)-2-(5-oxidanyl-3-oxidanylidene-4-phenyl-thiophen-2-ylidene)-2-phenyl-ethanoyl]amino]butanoic acid Openeye Name: 4-amino-2-[[(2E)-2-(5-hydroxy-3-oxo-4-phenyl-2-thienylidene)-2-phenyl-acetyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[(2E)-2-(5-hydroxy-3-oxo-4-phenyl-2-thiophenylidene)-1-oxo-2-phenylethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[(2E)-2-(5-hydroxy-3-oxo-4-phenylthiophen-2-ylidene)-2-phenylacetyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[(2E)-2-(5-hydroxy-3-keto-4-phenyl-2-thienylidene)-2-phenyl-acetyl]amino]-4-keto-butyric acid Formula: C22H18N2O6S MolecularWeight: 438.45312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC(=C(C3=CC=CC=C3)C(=O)NC(CC(=O)N)C(=O)O)C2=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(S/C(=C(\C3=CC=CC=C3)/C(=O)NC(CC(=O)N)C(=O)O)/C2=O)O

InChI

InChI=1S/C22H18N2O6S/c23-15(25)11-14(21(28)29)24-20(27)17(13-9-5-2-6-10-13)19-18(26)16(22(30)31-19)12-7-3-1-4-8-12/h1-10,14,30H,11H2,(H2,23,25)(H,24,27)(H,28,29)/b19-17+