N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-oxidanylidene-4-pyrrolidin-1-yl-butoxy)phenyl]-5-fluoranyl-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-oxidanylidene-4-pyrrolidin-1-yl-butoxy)phenyl]-5-fluoranyl-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-oxo-4-pyrrolidin-1-yl-butoxy)phenyl]-5-fluoro-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[4-[(2,2-dimethylpropylamino)-oxomethyl]-2-[4-oxo-4-(1-pyrrolidinyl)butoxy]phenyl]-5-fluoro-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[4-(2,2-dimethylpropylcarbamoyl)-2-(4-oxo-4-pyrrolidin-1-ylbutoxy)phenyl]-5-fluoro-4-methylbenzamide Traditional Name: N-cyclopropyl-3-fluoro-5-[2-(4-keto-4-pyrrolidino-butoxy)-4-(neopentylcarbamoyl)phenyl]-4-methyl-benzamide Formula: C31H40FN3O4 MolecularWeight: 537.665403

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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)N3CCCC3)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)N3CCCC3)C(=O)NC4CC4)F

InChI

InChI=1S/C31H40FN3O4/c1-20-25(16-22(17-26(20)32)30(38)34-23-10-11-23)24-12-9-21(29(37)33-19-31(2,3)4)18-27(24)39-15-7-8-28(36)35-13-5-6-14-35/h9,12,16-18,23H,5-8,10-11,13-15,19H2,1-4H3,(H,33,37)(H,34,38)