1-[(2S,4R,5R)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-4-(hexadecylamino)-5-methyl-pyrimidin-2-one

Systemtic Name: 1-[(2S,4R,5R)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-4-(hexadecylamino)-5-methyl-pyrimidin-2-one Openeye Name: 1-[(2S,4R,5R)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-(hexadecylamino)-5-methyl-pyrimidin-2-one CAS Name: 1-[(2S,4R,5R)-4-azido-5-(hydroxymethyl)-2-oxolanyl]-4-(hexadecylamino)-5-methyl-2-pyrimidinone IUPAC Name: 1-[(2S,4R,5R)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-4-(hexadecylamino)-5-methylpyrimidin-2-one Traditional Name: 1-[(2S,4R,5R)-4-azido-5-methylol-tetrahydrofuran-2-yl]-4-(cetylamino)-5-methyl-pyrimidin-2-one Formula: C26H46N6O3 MolecularWeight: 490.68184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NC(=O)N(C=C1C)C2CC(C(O2)CO)N=[N+]=[N-]

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NC(=O)N(C=C1C)[C@@H]2C[C@H]([C@@H](O2)CO)N=[N+]=[N-]

InChI

InChI=1S/C26H46N6O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28-25-21(2)19-32(26(34)29-25)24-18-22(30-31-27)23(20-33)35-24/h19,22-24,33H,3-18,20H2,1-2H3,(H,28,29,34)/t22-,23+,24+/m1/s1