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

Systemtic Name: (phenylmethyl) N-[1-[2-[[4,4-bis(fluoranyl)-3,5-bis(oxidanylidene)-1-phenyl-5-[(phenylmethyl)amino]pentan-2-yl]amino]-2-oxidanylidene-ethyl]-6-oxidanylidene-2-pyridin-3-yl-pyrimidin-5-yl]carbamate Openeye Name: benzyl N-[1-[2-[[1-benzyl-4-(benzylamino)-3,3-difluoro-2,4-dioxo-butyl]amino]-2-oxo-ethyl]-6-oxo-2-(3-pyridyl)pyrimidin-5-yl]carbamate CAS Name: N-[1-[2-[[4,4-difluoro-3,5-dioxo-1-phenyl-5-[(phenylmethyl)amino]pentan-2-yl]amino]-2-oxoethyl]-6-oxo-2-(3-pyridinyl)-5-pyrimidinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-[2-[[5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-phenylpentan-2-yl]amino]-2-oxoethyl]-6-oxo-2-pyridin-3-ylpyrimidin-5-yl]carbamate Traditional Name: N-[1-[2-[[1-benzyl-4-(benzylamino)-3,3-difluoro-2,4-diketo-butyl]amino]-2-keto-ethyl]-6-keto-2-(3-pyridyl)pyrimidin-5-yl]carbamic acid benzyl ester Formula: C37H32F2N6O6 MolecularWeight: 694.683386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H32F2N6O6/c38-37(39,35(49)42-20-26-13-6-2-7-14-26)32(47)29(19-25-11-4-1-5-12-25)43-31(46)23-45-33(28-17-10-18-40-21-28)41-22-30(34(45)48)44-36(50)51-24-27-15-8-3-9-16-27/h1-18,21-22,29H,19-20,23-24H2,(H,42,49)(H,43,46)(H,44,50)