N-[1-[3,5-bis(fluoranyl)phenyl]-3-oxidanyl-5-(5-oxidanylidenepyrrolidin-2-yl)pentan-2-yl]-4-butyl-8-(1,3-oxazol-2-yl)-2,3-dihydro-1,4-benzoxazine-6-carboxamide

Systemtic Name: N-[1-[3,5-bis(fluoranyl)phenyl]-3-oxidanyl-5-(5-oxidanylidenepyrrolidin-2-yl)pentan-2-yl]-4-butyl-8-(1,3-oxazol-2-yl)-2,3-dihydro-1,4-benzoxazine-6-carboxamide Openeye Name: 4-butyl-N-[1-[(3,5-difluorophenyl)methyl]-2-hydroxy-4-(5-oxopyrrolidin-2-yl)butyl]-8-oxazol-2-yl-2,3-dihydro-1,4-benzoxazine-6-carboxamide CAS Name: 4-butyl-N-[1-(3,5-difluorophenyl)-3-hydroxy-5-(5-oxo-2-pyrrolidinyl)pentan-2-yl]-8-(2-oxazolyl)-2,3-dihydro-1,4-benzoxazine-6-carboxamide IUPAC Name: 4-butyl-N-[1-(3,5-difluorophenyl)-3-hydroxy-5-(5-oxopyrrolidin-2-yl)pentan-2-yl]-8-(1,3-oxazol-2-yl)-2,3-dihydro-1,4-benzoxazine-6-carboxamide Traditional Name: 4-butyl-N-[1-(3,5-difluorobenzyl)-2-hydroxy-4-(5-ketopyrrolidin-2-yl)butyl]-8-oxazol-2-yl-2,3-dihydro-1,4-benzoxazine-6-carboxamide Formula: C31H36F2N4O5 MolecularWeight: 582.638146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCOC2=C1C=C(C=C2C3=NC=CO3)C(=O)NC(CC4=CC(=CC(=C4)F)F)C(CCC5CCC(=O)N5)O

Isomeric SMILES

CCCCN1CCOC2=C1C=C(C=C2C3=NC=CO3)C(=O)NC(CC4=CC(=CC(=C4)F)F)C(CCC5CCC(=O)N5)O

InChI

InChI=1S/C31H36F2N4O5/c1-2-3-9-37-10-12-41-29-24(31-34-8-11-42-31)16-20(17-26(29)37)30(40)36-25(15-19-13-21(32)18-22(33)14-19)27(38)6-4-23-5-7-28(39)35-23/h8,11,13-14,16-18,23,25,27,38H,2-7,9-10,12,15H2,1H3,(H,35,39)(H,36,40)