2-[(2S,4R,5S)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-[tert-butyl(dimethyl)silyl]oxy-3-phenylsulfanyl-2-[(triphenylmethyl)oxymethyl]oxolan-3-yl]ethanenitrile

Systemtic Name: 2-[(2S,4R,5S)-5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-4-[tert-butyl(dimethyl)silyl]oxy-3-phenylsulfanyl-2-[(triphenylmethyl)oxymethyl]oxolan-3-yl]ethanenitrile Openeye Name: 2-[(2S,4R,5S)-4-[tert-butyl(dimethyl)silyl]oxy-5-(2,4-dioxopyrimidin-1-yl)-3-phenylsulfanyl-2-(trityloxymethyl)tetrahydrofuran-3-yl]acetonitrile CAS Name: 2-[(2S,4R,5S)-4-[tert-butyl(dimethyl)silyl]oxy-5-(2,4-dioxo-1-pyrimidinyl)-3-(phenylthio)-2-[(triphenylmethyl)oxymethyl]-3-oxolanyl]acetonitrile IUPAC Name: 2-[(2S,4R,5S)-4-[tert-butyl(dimethyl)silyl]oxy-5-(2,4-dioxopyrimidin-1-yl)-3-phenylsulfanyl-2-(trityloxymethyl)oxolan-3-yl]acetonitrile Traditional Name: 2-[(2S,4R,5S)-4-[tert-butyl(dimethyl)silyl]oxy-5-(2,4-diketopyrimidin-1-yl)-3-(phenylthio)-2-(trityloxymethyl)tetrahydrofuran-3-yl]acetonitrile Formula: C42H45N3O5SSi MolecularWeight: 731.9743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Si](C)(C)OC1C(OC(C1(CC#N)SC2=CC=CC=C2)COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N6C=CC(=O)NC6=O

Isomeric SMILES

CC(C)(C)[Si](C)(C)O[C@@H]1[C@H](O[C@H](C1(CC#N)SC2=CC=CC=C2)COC(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)N6C=CC(=O)NC6=O

InChI

InChI=1S/C42H45N3O5SSi/c1-40(2,3)52(4,5)50-37-38(45-29-26-36(46)44-39(45)47)49-35(41(37,27-28-43)51-34-24-16-9-17-25-34)30-48-42(31-18-10-6-11-19-31,32-20-12-7-13-21-32)33-22-14-8-15-23-33/h6-26,29,35,37-38H,27,30H2,1-5H3,(H,44,46,47)/t35-,37+,38-,41?/m0/s1