1-[(2R,4S,5R)-4-azido-5-[(1-oxidanylidene-3-sulfanylidene-isoindol-2-yl)methyl]oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,4S,5R)-4-azido-5-[(1-oxidanylidene-3-sulfanylidene-isoindol-2-yl)methyl]oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,4S,5R)-4-azido-5-[(1-oxo-3-thioxo-isoindolin-2-yl)methyl]tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,4S,5R)-4-azido-5-[(1-oxo-3-sulfanylidene-2-isoindolyl)methyl]-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,4S,5R)-4-azido-5-[(1-oxo-3-sulfanylideneisoindol-2-yl)methyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,4S,5R)-4-azido-5-[(1-keto-3-thioxo-isoindolin-2-yl)methyl]tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C18H16N6O4S MolecularWeight: 412.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CN3C(=O)C4=CC=CC=C4C3=S)N=[N+]=[N-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CN3C(=O)C4=CC=CC=C4C3=S)N=[N+]=[N-]

InChI

InChI=1S/C18H16N6O4S/c1-9-7-23(18(27)20-15(9)25)14-6-12(21-22-19)13(28-14)8-24-16(26)10-4-2-3-5-11(10)17(24)29/h2-5,7,12-14H,6,8H2,1H3,(H,20,25,27)/t12-,13+,14+/m0/s1