2-[[2-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methylsulfanyl]-1H-imidazol-5-yl]amino]-2-oxidanylidene-ethanoate

Systemtic Name: 2-[[2-[(4-ethanoyl-3-oxidanyl-2-propyl-phenyl)methylsulfanyl]-1H-imidazol-5-yl]amino]-2-oxidanylidene-ethanoate Openeye Name: 2-[[2-[(4-acetyl-3-hydroxy-2-propyl-phenyl)methylsulfanyl]-1H-imidazol-5-yl]amino]-2-oxo-acetate CAS Name: 2-[[2-[(4-acetyl-3-hydroxy-2-propylphenyl)methylthio]-1H-imidazol-5-yl]amino]-2-oxoacetate IUPAC Name: 2-[[2-[(4-acetyl-3-hydroxy-2-propylphenyl)methylsulfanyl]-1H-imidazol-5-yl]amino]-2-oxoacetate Traditional Name: 2-[[2-[(4-acetyl-3-hydroxy-2-propyl-benzyl)thio]-1H-imidazol-5-yl]amino]-2-keto-acetate Formula: C17H18N3O5S- MolecularWeight: 376.40692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)CSC2=NC=C(N2)NC(=O)C(=O)[O-]

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)CSC2=NC=C(N2)NC(=O)C(=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c1-3-4-12-10(5-6-11(9(2)21)14(12)22)8-26-17-18-7-13(20-17)19-15(23)16(24)25/h5-7,22H,3-4,8H2,1-2H3,(H,18,20)(H,19,23)(H,24,25)/p-1