(phenylmethyl) N-[1-[2-[[4,4-bis(fluoranyl)-3-oxidanyl-5-oxidanylidene-1-phenyl-5-[(phenylmethyl)amino]pentan-2-yl]amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-pyridin-4-yl-pyrimidin-5-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-[2-[[4,4-bis(fluoranyl)-3-oxidanyl-5-oxidanylidene-1-phenyl-5-[(phenylmethyl)amino]pentan-2-yl]amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-pyridin-4-yl-pyrimidin-5-yl]carbamate Openeye Name: benzyl N-[1-[2-[[1-benzyl-4-(benzylamino)-3,3-difluoro-2-hydroxy-4-oxo-butyl]amino]-2-oxo-ethyl]-6-oxo-2-(4-pyridyl)pyrimidin-5-yl]carbamate CAS Name: N-[1-[2-[[4,4-difluoro-3-hydroxy-5-oxo-1-phenyl-5-[(phenylmethyl)amino]pentan-2-yl]amino]-2-oxoethyl]-6-oxo-2-pyridin-4-yl-5-pyrimidinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-[[5-(benzylamino)-4,4-difluoro-3-hydroxy-5-oxo-1-phenylpentan-2-yl]amino]-2-oxoethyl]-6-oxo-2-pyridin-4-ylpyrimidin-5-yl]carbamate Traditional Name: N-[1-[2-[[1-benzyl-4-(benzylamino)-3,3-difluoro-2-hydroxy-4-keto-butyl]amino]-2-keto-ethyl]-6-keto-2-(4-pyridyl)pyrimidin-5-yl]carbamic acid benzyl ester Formula: C37H34F2N6O6 MolecularWeight: 696.699266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(C(C(=O)NCC2=CC=CC=C2)(F)F)O)NC(=O)CN3C(=NC=C(C3=O)NC(=O)OCC4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC(C(C(C(=O)NCC2=CC=CC=C2)(F)F)O)NC(=O)CN3C(=NC=C(C3=O)NC(=O)OCC4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C37H34F2N6O6/c38-37(39,35(49)42-21-26-12-6-2-7-13-26)32(47)29(20-25-10-4-1-5-11-25)43-31(46)23-45-33(28-16-18-40-19-17-28)41-22-30(34(45)48)44-36(50)51-24-27-14-8-3-9-15-27/h1-19,22,29,32,47H,20-21,23-24H2,(H,42,49)(H,43,46)(H,44,50)