N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]-5-fluoranyl-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethoxy)phenyl]-5-fluoranyl-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(2-morpholino-2-oxo-ethoxy)phenyl]-5-fluoro-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[4-[(2,2-dimethylpropylamino)-oxomethyl]-2-[2-(4-morpholinyl)-2-oxoethoxy]phenyl]-5-fluoro-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-5-fluoro-4-methylbenzamide Traditional Name: N-cyclopropyl-3-fluoro-5-[2-(2-keto-2-morpholino-ethoxy)-4-(neopentylcarbamoyl)phenyl]-4-methyl-benzamide Formula: C29H36FN3O5 MolecularWeight: 525.611643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1C2=C(C=C(C=C2)C(=O)NCC(C)(C)C)OCC(=O)N3CCOCC3)C(=O)NC4CC4)F

Isomeric SMILES

CC1=C(C=C(C=C1C2=C(C=C(C=C2)C(=O)NCC(C)(C)C)OCC(=O)N3CCOCC3)C(=O)NC4CC4)F

InChI

InChI=1S/C29H36FN3O5/c1-18-23(13-20(14-24(18)30)28(36)32-21-6-7-21)22-8-5-19(27(35)31-17-29(2,3)4)15-25(22)38-16-26(34)33-9-11-37-12-10-33/h5,8,13-15,21H,6-7,9-12,16-17H2,1-4H3,(H,31,35)(H,32,36)