N-[1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxidanylidene-pyrimidin-4-yl]quinoline-3-carboxamide

Systemtic Name: N-[1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxidanylidene-pyrimidin-4-yl]quinoline-3-carboxamide Openeye Name: N-[1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-pyrimidin-4-yl]quinoline-3-carboxamide CAS Name: N-[1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxo-4-pyrimidinyl]-3-quinolinecarboxamide IUPAC Name: N-[1-[(2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-oxopyrimidin-4-yl]quinoline-3-carboxamide Traditional Name: N-[2-keto-1-[(2R,5S)-2-methylol-1,3-oxathiolan-5-yl]pyrimidin-4-yl]quinoline-3-carboxamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(S1)CO)N2C=CC(=NC2=O)NC(=O)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

C1[C@H](O[C@H](S1)CO)N2C=CC(=NC2=O)NC(=O)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C18H16N4O4S/c23-9-16-26-15(10-27-16)22-6-5-14(21-18(22)25)20-17(24)12-7-11-3-1-2-4-13(11)19-8-12/h1-8,15-16,23H,9-10H2,(H,20,21,24,25)/t15-,16+/m0/s1