N4-[(4-fluoranyl-3-methyl-phenyl)methyl]-N6-[[4-[2-oxidanylidene-2-(propan-2-ylamino)ethoxy]phenyl]methyl]pyrimidine-4,6-dicarboxamide

Systemtic Name: N4-[(4-fluoranyl-3-methyl-phenyl)methyl]-N6-[[4-[2-oxidanylidene-2-(propan-2-ylamino)ethoxy]phenyl]methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N4-[(4-fluoro-3-methyl-phenyl)methyl]-N6-[[4-[2-(isopropylamino)-2-oxo-ethoxy]phenyl]methyl]pyrimidine-4,6-dicarboxamide CAS Name: N4-[(4-fluoro-3-methylphenyl)methyl]-N6-[[4-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N-[(4-fluoro-3-methylphenyl)methyl]-6-N-[[4-[2-oxo-2-(propan-2-ylamino)ethoxy]phenyl]methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-N'-[4-[2-(isopropylamino)-2-keto-ethoxy]benzyl]pyrimidine-4,6-dicarboxamide Formula: C26H28FN5O4 MolecularWeight: 493.530023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC=C(C=C3)OCC(=O)NC(C)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC=C(C=C3)OCC(=O)NC(C)C)F

InChI

InChI=1S/C26H28FN5O4/c1-16(2)32-24(33)14-36-20-7-4-18(5-8-20)12-28-25(34)22-11-23(31-15-30-22)26(35)29-13-19-6-9-21(27)17(3)10-19/h4-11,15-16H,12-14H2,1-3H3,(H,28,34)(H,29,35)(H,32,33)