[5-[5-[bis(4-chlorophenyl)methyl]-2-oxidanylidene-4-sulfanylidene-pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate

Systemtic Name: [5-[5-[bis(4-chlorophenyl)methyl]-2-oxidanylidene-4-sulfanylidene-pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate Openeye Name: [5-[5-[bis(4-chlorophenyl)methyl]-2-oxo-4-thioxo-pyrimidin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate CAS Name: [5-[5-[bis(4-chlorophenyl)methyl]-2-oxo-4-sulfanylidene-1-pyrimidinyl]-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate IUPAC Name: [5-[5-[bis(4-chlorophenyl)methyl]-2-oxo-4-sulfanylidenepyrimidin-1-yl]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate Traditional Name: [5-[5-[bis(4-chlorophenyl)methyl]-2-keto-4-thioxo-pyrimidin-1-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate Formula: C22H21Cl2N2O8PS MolecularWeight: 575.355501

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C3=CN(C(=O)NC3=S)C4C(C(C(O4)COP(=O)(O)O)O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C3=CN(C(=O)NC3=S)C4C(C(C(O4)COP(=O)(O)O)O)O)Cl

InChI

InChI=1S/C22H21Cl2N2O8PS/c23-13-5-1-11(2-6-13)17(12-3-7-14(24)8-4-12)15-9-26(22(29)25-20(15)36)21-19(28)18(27)16(34-21)10-33-35(30,31)32/h1-9,16-19,21,27-28H,10H2,(H,25,29,36)(H2,30,31,32)