N-[6-azanyl-5-[[1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-2-oxidanylidene-pyrimidin-4-yl]amino]pyrimidin-4-yl]-N-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methanamide

Systemtic Name: N-[6-azanyl-5-[[1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-5-methyl-2-oxidanylidene-pyrimidin-4-yl]amino]pyrimidin-4-yl]-N-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]methanamide Openeye Name: N-[6-amino-5-[[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-2-oxo-pyrimidin-4-yl]amino]pyrimidin-4-yl]-N-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]formamide CAS Name: N-[6-amino-5-[[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-5-methyl-2-oxo-4-pyrimidinyl]amino]-4-pyrimidinyl]-N-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]formamide IUPAC Name: N-[6-amino-5-[[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-2-oxopyrimidin-4-yl]amino]pyrimidin-4-yl]-N-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]formamide Traditional Name: N-[6-amino-5-[[1-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-2-keto-5-methyl-pyrimidin-4-yl]amino]pyrimidin-4-yl]-N-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]formamide Formula: C20H27N7O9 MolecularWeight: 509.46988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)N=C1NC2=C(N=CN=C2N(C=O)C3C(C(C(O3)CO)O)O)N)C4CC(C(O4)CO)O

Isomeric SMILES

CC1=CN(C(=O)N=C1NC2=C(N=CN=C2N(C=O)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N)[C@H]4C[C@@H]([C@H](O4)CO)O

InChI

InChI=1S/C20H27N7O9/c1-8-3-26(12-2-9(31)10(4-28)35-12)20(34)25-17(8)24-13-16(21)22-6-23-18(13)27(7-30)19-15(33)14(32)11(5-29)36-19/h3,6-7,9-12,14-15,19,28-29,31-33H,2,4-5H2,1H3,(H2,21,22,23)(H,24,25,34)/t9-,10+,11+,12+,14+,15+,19+/m0/s1