1-[(2R,5S)-5-(hydroxymethyl)-4-isothiocyanato-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[(2R,5S)-5-(hydroxymethyl)-4-isothiocyanato-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[(2R,5S)-5-(hydroxymethyl)-4-isothiocyanato-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[(2R,5S)-5-(hydroxymethyl)-4-isothiocyanato-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[(2R,5S)-5-(hydroxymethyl)-4-isothiocyanatooxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[(2R,5S)-4-isothiocyanato-5-methylol-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C11H13N3O4S MolecularWeight: 283.30362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)N=C=S

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2CC([C@H](O2)CO)N=C=S

InChI

InChI=1S/C11H13N3O4S/c1-6-3-14(11(17)13-10(6)16)9-2-7(12-5-19)8(4-15)18-9/h3,7-9,15H,2,4H2,1H3,(H,13,16,17)/t7?,8-,9-/m1/s1