[3-acetyloxy-5-[5-bromanyl-4-[(2-methyl-6-oxidanyl-phenyl)amino]-2-oxidanylidene-pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate

Systemtic Name: [3-acetyloxy-5-[5-bromanyl-4-[(2-methyl-6-oxidanyl-phenyl)amino]-2-oxidanylidene-pyrimidin-1-yl]oxolan-2-yl]methyl ethanoate Openeye Name: [3-acetoxy-5-[5-bromo-4-(2-hydroxy-6-methyl-anilino)-2-oxo-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [3-acetyloxy-5-[5-bromo-4-(2-hydroxy-6-methylanilino)-2-oxo-1-pyrimidinyl]-2-oxolanyl]methyl ester IUPAC Name: [3-acetyloxy-5-[5-bromo-4-(2-hydroxy-6-methylanilino)-2-oxopyrimidin-1-yl]oxolan-2-yl]methyl acetate Traditional Name: acetic acid [3-acetoxy-5-[5-bromo-4-(2-hydroxy-6-methyl-anilino)-2-keto-pyrimidin-1-yl]tetrahydrofuran-2-yl]methyl ester Formula: C20H22BrN3O7 MolecularWeight: 496.30858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)O)NC2=NC(=O)N(C=C2Br)C3CC(C(O3)COC(=O)C)OC(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)O)NC2=NC(=O)N(C=C2Br)C3CC(C(O3)COC(=O)C)OC(=O)C

InChI

InChI=1S/C20H22BrN3O7/c1-10-5-4-6-14(27)18(10)22-19-13(21)8-24(20(28)23-19)17-7-15(30-12(3)26)16(31-17)9-29-11(2)25/h4-6,8,15-17,27H,7,9H2,1-3H3,(H,22,23,28)