9-[2-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]-8-bromanyl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 9-[2-[4-azanyl-1-methyl-2,6-bis(oxidanylidene)-3-propyl-pyrimidin-5-yl]-2-oxidanylidene-ethyl]-8-bromanyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 9-[2-(4-amino-1-methyl-2,6-dioxo-3-propyl-pyrimidin-5-yl)-2-oxo-ethyl]-8-bromo-1,3-dimethyl-purine-2,6-dione CAS Name: 9-[2-(4-amino-1-methyl-2,6-dioxo-3-propyl-5-pyrimidinyl)-2-oxoethyl]-8-bromo-1,3-dimethylpurine-2,6-dione IUPAC Name: 9-[2-(4-amino-1-methyl-2,6-dioxo-3-propylpyrimidin-5-yl)-2-oxoethyl]-8-bromo-1,3-dimethylpurine-2,6-dione Traditional Name: 9-[2-(4-amino-2,6-diketo-1-methyl-3-propyl-pyrimidin-5-yl)-2-keto-ethyl]-8-bromo-1,3-dimethyl-xanthine Formula: C17H20BrN7O5 MolecularWeight: 482.2886

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)CN2C3=C(C(=O)N(C(=O)N3C)C)N=C2Br)N

Isomeric SMILES

CCCN1C(=C(C(=O)N(C1=O)C)C(=O)CN2C3=C(C(=O)N(C(=O)N3C)C)N=C2Br)N

InChI

InChI=1S/C17H20BrN7O5/c1-5-6-24-11(19)9(13(27)22(3)17(24)30)8(26)7-25-12-10(20-15(25)18)14(28)23(4)16(29)21(12)2/h5-7,19H2,1-4H3