(2R)-2-[[6-azanyl-5-(furan-2-ylcarbonylamino)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]hexanoate

Systemtic Name: (2R)-2-[[6-azanyl-5-(furan-2-ylcarbonylamino)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]hexanoate Openeye Name: (2R)-2-[[6-amino-5-(furan-2-carbonylamino)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]hexanoate CAS Name: (2R)-2-[[6-amino-5-[[2-furanyl(oxo)methyl]amino]-4-oxo-1H-pyrimidin-2-yl]thio]hexanoate IUPAC Name: (2R)-2-[[6-amino-5-(furan-2-carbonylamino)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]hexanoate Traditional Name: (2R)-2-[[6-amino-5-(2-furoylamino)-4-keto-1H-pyrimidin-2-yl]thio]hexanoate Formula: C15H17N4O5S- MolecularWeight: 365.38428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])SC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=CO2

Isomeric SMILES

CCCC[C@H](C(=O)[O-])SC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=CO2

InChI

InChI=1S/C15H18N4O5S/c1-2-3-6-9(14(22)23)25-15-18-11(16)10(13(21)19-15)17-12(20)8-5-4-7-24-8/h4-5,7,9H,2-3,6H2,1H3,(H,17,20)(H,22,23)(H3,16,18,19,21)/p-1/t9-/m1/s1