[4-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-3-iodanyl-2-(4-methylphenyl)carbonyloxy-cyclopentyl]methyl 4-methylbenzoate

Systemtic Name: [4-(4-azanyl-5-fluoranyl-2-oxidanylidene-pyrimidin-1-yl)-3-iodanyl-2-(4-methylphenyl)carbonyloxy-cyclopentyl]methyl 4-methylbenzoate Openeye Name: [4-(4-amino-5-fluoro-2-oxo-pyrimidin-1-yl)-3-iodo-2-(4-methylbenzoyl)oxy-cyclopentyl]methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-(4-amino-5-fluoro-2-oxo-1-pyrimidinyl)-3-iodo-2-[(4-methylphenyl)-oxomethoxy]cyclopentyl]methyl ester IUPAC Name: [4-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-3-iodo-2-(4-methylbenzoyl)oxycyclopentyl]methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-(4-amino-5-fluoro-2-keto-pyrimidin-1-yl)-3-iodo-2-p-toluoyloxy-cyclopentyl]methyl ester Formula: C26H25FIN3O5 MolecularWeight: 605.396673

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC2CC(C(C2OC(=O)C3=CC=C(C=C3)C)I)N4C=C(C(=NC4=O)N)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC2CC(C(C2OC(=O)C3=CC=C(C=C3)C)I)N4C=C(C(=NC4=O)N)F

InChI

InChI=1S/C26H25FIN3O5/c1-14-3-7-16(8-4-14)24(32)35-13-18-11-20(31-12-19(27)23(29)30-26(31)34)21(28)22(18)36-25(33)17-9-5-15(2)6-10-17/h3-10,12,18,20-22H,11,13H2,1-2H3,(H2,29,30,34)