[(2R,3R)-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxan-3-yl] thiocyanate

Systemtic Name: [(2R,3R)-2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxan-3-yl] thiocyanate Openeye Name: [(2R,3R)-2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydropyran-3-yl] thiocyanate CAS Name: thiocyanic acid [(2R,3R)-2-(5-methyl-2,4-dioxo-1-pyrimidinyl)-3-oxanyl] ester IUPAC Name: [(2R,3R)-2-(5-methyl-2,4-dioxopyrimidin-1-yl)oxan-3-yl] thiocyanate Traditional Name: thiocyanic acid [(2R,3R)-2-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydropyran-3-yl] ester Formula: C11H13N3O3S MolecularWeight: 267.30422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2C(CCCO2)SC#N

Isomeric SMILES

CC1=CN(C(=O)NC1=O)[C@H]2[C@@H](CCCO2)SC#N

InChI

InChI=1S/C11H13N3O3S/c1-7-5-14(11(16)13-9(7)15)10-8(18-6-12)3-2-4-17-10/h5,8,10H,2-4H2,1H3,(H,13,15,16)/t8-,10-/m1/s1