N-tert-butyl-5-[[4-[3-fluoranyl-4-(2-methylpropylcarbamoylamino)phenyl]carbonylpiperazin-1-yl]methyl]furan-2-carboxamide

Systemtic Name: N-tert-butyl-5-[[4-[3-fluoranyl-4-(2-methylpropylcarbamoylamino)phenyl]carbonylpiperazin-1-yl]methyl]furan-2-carboxamide Openeye Name: N-tert-butyl-5-[[4-[3-fluoro-4-(isobutylcarbamoylamino)benzoyl]piperazin-1-yl]methyl]furan-2-carboxamide CAS Name: N-tert-butyl-5-[[4-[[3-fluoro-4-[[(2-methylpropylamino)-oxomethyl]amino]phenyl]-oxomethyl]-1-piperazinyl]methyl]-2-furancarboxamide IUPAC Name: N-tert-butyl-5-[[4-[3-fluoro-4-(2-methylpropylcarbamoylamino)benzoyl]piperazin-1-yl]methyl]furan-2-carboxamide Traditional Name: N-tert-butyl-5-[[4-[3-fluoro-4-(isobutylcarbamoylamino)benzoyl]piperazino]methyl]-2-furamide Formula: C26H36FN5O4 MolecularWeight: 501.593543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(O3)C(=O)NC(C)(C)C)F

Isomeric SMILES

CC(C)CNC(=O)NC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=C(O3)C(=O)NC(C)(C)C)F

InChI

InChI=1S/C26H36FN5O4/c1-17(2)15-28-25(35)29-21-8-6-18(14-20(21)27)24(34)32-12-10-31(11-13-32)16-19-7-9-22(36-19)23(33)30-26(3,4)5/h6-9,14,17H,10-13,15-16H2,1-5H3,(H,30,33)(H2,28,29,35)