4-[(4-fluorophenyl)sulfonylamino]-2-[3-(imidazol-1-ylmethyl)phenyl]-2-methyl-butanoic acid

Systemtic Name: 4-[(4-fluorophenyl)sulfonylamino]-2-[3-(imidazol-1-ylmethyl)phenyl]-2-methyl-butanoic acid Openeye Name: 4-[(4-fluorophenyl)sulfonylamino]-2-[3-(imidazol-1-ylmethyl)phenyl]-2-methyl-butanoic acid CAS Name: 4-[(4-fluorophenyl)sulfonylamino]-2-[3-(1-imidazolylmethyl)phenyl]-2-methylbutanoic acid IUPAC Name: 4-[(4-fluorophenyl)sulfonylamino]-2-[3-(imidazol-1-ylmethyl)phenyl]-2-methylbutanoic acid Traditional Name: 4-[(4-fluorophenyl)sulfonylamino]-2-[3-(imidazol-1-ylmethyl)phenyl]-2-methyl-butyric acid Formula: C21H22FN3O4S MolecularWeight: 431.480483

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNS(=O)(=O)C1=CC=C(C=C1)F)(C2=CC=CC(=C2)CN3C=CN=C3)C(=O)O

Isomeric SMILES

CC(CCNS(=O)(=O)C1=CC=C(C=C1)F)(C2=CC=CC(=C2)CN3C=CN=C3)C(=O)O

InChI

InChI=1S/C21H22FN3O4S/c1-21(20(26)27,9-10-24-30(28,29)19-7-5-18(22)6-8-19)17-4-2-3-16(13-17)14-25-12-11-23-15-25/h2-8,11-13,15,24H,9-10,14H2,1H3,(H,26,27)