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

Systemtic Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-morpholin-4-yl-4-oxidanylidene-butoxy)phenyl]-5-fluoranyl-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-morpholino-4-oxo-butoxy)phenyl]-5-fluoro-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[4-[(2,2-dimethylpropylamino)-oxomethyl]-2-[4-(4-morpholinyl)-4-oxobutoxy]phenyl]-5-fluoro-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-morpholin-4-yl-4-oxobutoxy)phenyl]-5-fluoro-4-methylbenzamide Traditional Name: N-cyclopropyl-3-fluoro-5-[2-(4-keto-4-morpholino-butoxy)-4-(neopentylcarbamoyl)phenyl]-4-methyl-benzamide Formula: C31H40FN3O5 MolecularWeight: 553.664803

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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)OCCCC(=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)OCCCC(=O)N3CCOCC3)C(=O)NC4CC4)F

InChI

InChI=1S/C31H40FN3O5/c1-20-25(16-22(17-26(20)32)30(38)34-23-8-9-23)24-10-7-21(29(37)33-19-31(2,3)4)18-27(24)40-13-5-6-28(36)35-11-14-39-15-12-35/h7,10,16-18,23H,5-6,8-9,11-15,19H2,1-4H3,(H,33,37)(H,34,38)