5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[(3-chloranyl-4-fluoranyl-phenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-isobutyl-2-pyrrolidin-1-yl-benzamide CAS Name: 5-[[(3-chloro-4-fluoroanilino)-oxomethyl]amino]-N-(2-methylpropyl)-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[(3-chloro-4-fluorophenyl)carbamoylamino]-N-(2-methylpropyl)-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[(3-chloro-4-fluoro-phenyl)carbamoylamino]-N-isobutyl-2-pyrrolidino-benzamide Formula: C22H26ClFN4O2 MolecularWeight: 432.918843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)N3CCCC3

Isomeric SMILES

CC(C)CNC(=O)C1=C(C=CC(=C1)NC(=O)NC2=CC(=C(C=C2)F)Cl)N3CCCC3

InChI

InChI=1S/C22H26ClFN4O2/c1-14(2)13-25-21(29)17-11-15(6-8-20(17)28-9-3-4-10-28)26-22(30)27-16-5-7-19(24)18(23)12-16/h5-8,11-12,14H,3-4,9-10,13H2,1-2H3,(H,25,29)(H2,26,27,30)