[5-[4-acetamido-7-ethyl-5-fluoranyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid

Systemtic Name: [5-[4-acetamido-7-ethyl-5-fluoranyl-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Openeye Name: [5-(4-acetamido-7-ethyl-5-fluoro-1-isobutyl-benzimidazol-2-yl)-2-furyl]phosphonic acid CAS Name: [5-[4-acetamido-7-ethyl-5-fluoro-1-(2-methylpropyl)-2-benzimidazolyl]-2-furanyl]phosphonic acid IUPAC Name: [5-[4-acetamido-7-ethyl-5-fluoro-1-(2-methylpropyl)benzimidazol-2-yl]furan-2-yl]phosphonic acid Traditional Name: [5-(4-acetamido-7-ethyl-5-fluoro-1-isobutyl-benzimidazol-2-yl)-2-furyl]phosphonic acid Formula: C19H23FN3O5P MolecularWeight: 423.375184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C2=C1N(C(=N2)C3=CC=C(O3)P(=O)(O)O)CC(C)C)NC(=O)C)F

Isomeric SMILES

CCC1=CC(=C(C2=C1N(C(=N2)C3=CC=C(O3)P(=O)(O)O)CC(C)C)NC(=O)C)F

InChI

InChI=1S/C19H23FN3O5P/c1-5-12-8-13(20)16(21-11(4)24)17-18(12)23(9-10(2)3)19(22-17)14-6-7-15(28-14)29(25,26)27/h6-8,10H,5,9H2,1-4H3,(H,21,24)(H2,25,26,27)