6-[[2-[5-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]thiophen-2-yl]-5-phenyl-3-(2-phenylpropyl)imidazol-4-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[2-[5-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]thiophen-2-yl]-5-phenyl-3-(2-phenylpropyl)imidazol-4-yl]carbonylamino]hexanoic acid Openeye Name: 6-[[2-[5-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-2-thienyl]-5-phenyl-3-(2-phenylpropyl)imidazole-4-carbonyl]amino]hexanoic acid CAS Name: 6-[[[2-[5-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2-thiophenyl]-5-phenyl-3-(2-phenylpropyl)-4-imidazolyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[[2-[5-[(E)-3-hydroxy-3-oxoprop-1-enyl]thiophen-2-yl]-5-phenyl-3-(2-phenylpropyl)imidazole-4-carbonyl]amino]hexanoic acid Traditional Name: 6-[[2-[5-[(E)-3-hydroxy-3-keto-prop-1-enyl]-2-thienyl]-5-phenyl-3-(2-phenylpropyl)imidazole-4-carbonyl]amino]hexanoic acid Formula: C32H33N3O5S MolecularWeight: 571.68652

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=C(N=C1C2=CC=C(S2)C=CC(=O)O)C3=CC=CC=C3)C(=O)NCCCCCC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC(CN1C(=C(N=C1C2=CC=C(S2)/C=C/C(=O)O)C3=CC=CC=C3)C(=O)NCCCCCC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C32H33N3O5S/c1-22(23-11-5-2-6-12-23)21-35-30(32(40)33-20-10-4-9-15-27(36)37)29(24-13-7-3-8-14-24)34-31(35)26-18-16-25(41-26)17-19-28(38)39/h2-3,5-8,11-14,16-19,22H,4,9-10,15,20-21H2,1H3,(H,33,40)(H,36,37)(H,38,39)/b19-17+