(2S,3S,4S)-2-[2-azanyl-1-[(2S,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-methoxy-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-ethoxy]-3,4-bis(oxidanyl)-N-(2-thiophen-2-ylethyl)-3,4-dihydro-2H-pyran-6-carboxamide

Systemtic Name: (2S,3S,4S)-2-[2-azanyl-1-[(2S,3S,4R,5R)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-methoxy-4-oxidanyl-oxolan-2-yl]-2-oxidanylidene-ethoxy]-3,4-bis(oxidanyl)-N-(2-thiophen-2-ylethyl)-3,4-dihydro-2H-pyran-6-carboxamide Openeye Name: (2S,3S,4S)-2-[2-amino-1-[(2S,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-3-methoxy-tetrahydrofuran-2-yl]-2-oxo-ethoxy]-3,4-dihydroxy-N-[2-(2-thienyl)ethyl]-3,4-dihydro-2H-pyran-6-carboxamide CAS Name: (2S,3S,4S)-2-[2-amino-1-[(2S,3S,4R,5R)-5-(2,4-dioxo-1-pyrimidinyl)-4-hydroxy-3-methoxy-2-oxolanyl]-2-oxoethoxy]-3,4-dihydroxy-N-(2-thiophen-2-ylethyl)-3,4-dihydro-2H-pyran-6-carboxamide IUPAC Name: (2S,3S,4S)-2-[2-amino-1-[(2S,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxy-3-methoxyoxolan-2-yl]-2-oxoethoxy]-3,4-dihydroxy-N-(2-thiophen-2-ylethyl)-3,4-dihydro-2H-pyran-6-carboxamide Traditional Name: (2S,3S,4S)-2-[2-amino-1-[(2S,3S,4R,5R)-5-(2,4-diketopyrimidin-1-yl)-4-hydroxy-3-methoxy-tetrahydrofuran-2-yl]-2-keto-ethoxy]-3,4-dihydroxy-N-[2-(2-thienyl)ethyl]-3,4-dihydro-2H-pyran-6-carboxamide Formula: C23H28N4O11S MolecularWeight: 568.55362

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(C(OC1C(C(=O)N)OC2C(C(C=C(O2)C(=O)NCCC3=CC=CS3)O)O)N4C=CC(=O)NC4=O)O

Isomeric SMILES

CO[C@H]1[C@H]([C@@H](O[C@@H]1C(C(=O)N)O[C@@H]2[C@H]([C@H](C=C(O2)C(=O)NCCC3=CC=CS3)O)O)N4C=CC(=O)NC4=O)O

InChI

InChI=1S/C23H28N4O11S/c1-35-16-15(31)21(27-7-5-13(29)26-23(27)34)37-17(16)18(19(24)32)38-22-14(30)11(28)9-12(36-22)20(33)25-6-4-10-3-2-8-39-10/h2-3,5,7-9,11,14-18,21-22,28,30-31H,4,6H2,1H3,(H2,24,32)(H,25,33)(H,26,29,34)/t11-,14-,15+,16-,17-,18?,21+,22+/m0/s1