5-nitro-1-[(2R,4S,5S)-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 5-nitro-1-[(2R,4S,5S)-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-2-yl]pyrimidine-2,4-dione Openeye Name: 1-[(2R,4S,5S)-4-benzyloxy-5-(benzyloxymethyl)tetrahydrothiophen-2-yl]-5-nitro-pyrimidine-2,4-dione CAS Name: 5-nitro-1-[(2R,4S,5S)-4-phenylmethoxy-5-(phenylmethoxymethyl)-2-thiolanyl]pyrimidine-2,4-dione IUPAC Name: 5-nitro-1-[(2R,4S,5S)-4-phenylmethoxy-5-(phenylmethoxymethyl)thiolan-2-yl]pyrimidine-2,4-dione Traditional Name: 1-[(2R,4S,5S)-4-benzoxy-5-(benzoxymethyl)tetrahydrothiophen-2-yl]-5-nitro-pyrimidine-2,4-quinone Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(SC1N2C=C(C(=O)NC2=O)[N+](=O)[O-])COCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1[C@@H]([C@@H](S[C@H]1N2C=C(C(=O)NC2=O)[N+](=O)[O-])COCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C23H23N3O6S/c27-22-18(26(29)30)12-25(23(28)24-22)21-11-19(32-14-17-9-5-2-6-10-17)20(33-21)15-31-13-16-7-3-1-4-8-16/h1-10,12,19-21H,11,13-15H2,(H,24,27,28)/t19-,20-,21+/m0/s1