N-tert-butyl-4-[4-[(3-fluorophenyl)carbonylamino]-2-pyrrolidin-1-ylcarbonyl-phenyl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[4-[(3-fluorophenyl)carbonylamino]-2-pyrrolidin-1-ylcarbonyl-phenyl]piperazine-1-carboxamide Openeye Name: N-tert-butyl-4-[4-[(3-fluorobenzoyl)amino]-2-(pyrrolidine-1-carbonyl)phenyl]piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[4-[[(3-fluorophenyl)-oxomethyl]amino]-2-[oxo(1-pyrrolidinyl)methyl]phenyl]-1-piperazinecarboxamide IUPAC Name: N-tert-butyl-4-[4-[(3-fluorobenzoyl)amino]-2-(pyrrolidine-1-carbonyl)phenyl]piperazine-1-carboxamide Traditional Name: N-tert-butyl-4-[4-[(3-fluorobenzoyl)amino]-2-(pyrrolidine-1-carbonyl)phenyl]piperazine-1-carboxamide Formula: C27H34FN5O3 MolecularWeight: 495.588963

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)F)C(=O)N4CCCC4

Isomeric SMILES

CC(C)(C)NC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=CC=C3)F)C(=O)N4CCCC4

InChI

InChI=1S/C27H34FN5O3/c1-27(2,3)30-26(36)33-15-13-31(14-16-33)23-10-9-21(18-22(23)25(35)32-11-4-5-12-32)29-24(34)19-7-6-8-20(28)17-19/h6-10,17-18H,4-5,11-16H2,1-3H3,(H,29,34)(H,30,36)