tert-butyl N-[[3-chloranyl-2-(cyclopropylamino)-5-fluoranyl-4-pyrrolidin-1-yl-phenyl]carbonylamino]carbamate

Systemtic Name: tert-butyl N-[[3-chloranyl-2-(cyclopropylamino)-5-fluoranyl-4-pyrrolidin-1-yl-phenyl]carbonylamino]carbamate Openeye Name: tert-butyl N-[[3-chloro-2-(cyclopropylamino)-5-fluoro-4-pyrrolidin-1-yl-benzoyl]amino]carbamate CAS Name: N-[[[3-chloro-2-(cyclopropylamino)-5-fluoro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[3-chloro-2-(cyclopropylamino)-5-fluoro-4-pyrrolidin-1-ylbenzoyl]amino]carbamate Traditional Name: N-[[3-chloro-2-(cyclopropylamino)-5-fluoro-4-pyrrolidino-benzoyl]amino]carbamic acid tert-butyl ester Formula: C19H26ClFN4O3 MolecularWeight: 412.886143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=O)C1=CC(=C(C(=C1NC2CC2)Cl)N3CCCC3)F

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=O)C1=CC(=C(C(=C1NC2CC2)Cl)N3CCCC3)F

InChI

InChI=1S/C19H26ClFN4O3/c1-19(2,3)28-18(27)24-23-17(26)12-10-13(21)16(25-8-4-5-9-25)14(20)15(12)22-11-6-7-11/h10-11,22H,4-9H2,1-3H3,(H,23,26)(H,24,27)