N2-(4-azanylcyclohexyl)-3-[3,5-bis(fluoranyl)phenyl]carbonyl-N1-prop-2-enyl-imidazolidine-1,2-dicarboxamide

Systemtic Name: N2-(4-azanylcyclohexyl)-3-[3,5-bis(fluoranyl)phenyl]carbonyl-N1-prop-2-enyl-imidazolidine-1,2-dicarboxamide Openeye Name: N1-allyl-N2-(4-aminocyclohexyl)-3-(3,5-difluorobenzoyl)imidazolidine-1,2-dicarboxamide CAS Name: N2-(4-aminocyclohexyl)-3-[(3,5-difluorophenyl)-oxomethyl]-N1-prop-2-enylimidazolidine-1,2-dicarboxamide IUPAC Name: 2-N-(4-aminocyclohexyl)-3-(3,5-difluorobenzoyl)-1-N-prop-2-enylimidazolidine-1,2-dicarboxamide Traditional Name: N-allyl-N'-(4-aminocyclohexyl)-3-(3,5-difluorobenzoyl)imidazolidine-1,2-dicarboxamide Formula: C21H27F2N5O3 MolecularWeight: 435.467586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)N1CCN(C1C(=O)NC2CCC(CC2)N)C(=O)C3=CC(=CC(=C3)F)F

Isomeric SMILES

C=CCNC(=O)N1CCN(C1C(=O)NC2CCC(CC2)N)C(=O)C3=CC(=CC(=C3)F)F

InChI

InChI=1S/C21H27F2N5O3/c1-2-7-25-21(31)28-9-8-27(20(30)13-10-14(22)12-15(23)11-13)19(28)18(29)26-17-5-3-16(24)4-6-17/h2,10-12,16-17,19H,1,3-9,24H2,(H,25,31)(H,26,29)