methyl 2-[[4-[(5-fluoranyl-2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[[4-[(5-fluoranyl-2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[[4-[(5-fluoro-2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-4-methyl-pentanoate CAS Name: 2-[[4-[(5-fluoro-2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[4-[(5-fluoro-2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-4-methylpentanoate Traditional Name: 2-[[4-[(5-fluoro-2-methyl-2,3-dihydrobenzimidazol-1-yl)methyl]phenyl]sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C22H28FN3O4S MolecularWeight: 449.538823

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Descriptors Computed from Structure

Canonical SMILES:

CC1NC2=C(N1CC3=CC=C(C=C3)S(=O)(=O)NC(CC(C)C)C(=O)OC)C=CC(=C2)F

Isomeric SMILES

CC1NC2=C(N1CC3=CC=C(C=C3)S(=O)(=O)NC(CC(C)C)C(=O)OC)C=CC(=C2)F

InChI

InChI=1S/C22H28FN3O4S/c1-14(2)11-20(22(27)30-4)25-31(28,29)18-8-5-16(6-9-18)13-26-15(3)24-19-12-17(23)7-10-21(19)26/h5-10,12,14-15,20,24-25H,11,13H2,1-4H3