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

Systemtic Name: 1-[(2S,4R,5S)-4,5-bis(phenylmethoxymethyl)thiolan-2-yl]-5-ethyl-pyrimidine-2,4-dione Openeye Name: 1-[(2S,4R,5S)-4,5-bis(benzyloxymethyl)tetrahydrothiophen-2-yl]-5-ethyl-pyrimidine-2,4-dione CAS Name: 1-[(2S,4R,5S)-4,5-bis(phenylmethoxymethyl)-2-thiolanyl]-5-ethylpyrimidine-2,4-dione IUPAC Name: 1-[(2S,4R,5S)-4,5-bis(phenylmethoxymethyl)thiolan-2-yl]-5-ethylpyrimidine-2,4-dione Traditional Name: 1-[(2S,4R,5S)-4,5-bis(benzoxymethyl)tetrahydrothiophen-2-yl]-5-ethyl-pyrimidine-2,4-quinone Formula: C26H30N2O4S MolecularWeight: 466.5924

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)NC1=O)C2CC(C(S2)COCC3=CC=CC=C3)COCC4=CC=CC=C4

Isomeric SMILES

CCC1=CN(C(=O)NC1=O)[C@@H]2C[C@@H]([C@H](S2)COCC3=CC=CC=C3)COCC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4S/c1-2-21-14-28(26(30)27-25(21)29)24-13-22(17-31-15-19-9-5-3-6-10-19)23(33-24)18-32-16-20-11-7-4-8-12-20/h3-12,14,22-24H,2,13,15-18H2,1H3,(H,27,29,30)/t22-,23-,24+/m1/s1