2-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-methoxy-pyrimidin-4-olate

Systemtic Name: 2-[(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-methoxy-pyrimidin-4-olate Openeye Name: 2-[(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl]sulfanyl-6-methoxy-pyrimidin-4-olate CAS Name: 2-[[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]thio]-6-methoxy-4-pyrimidinolate IUPAC Name: 2-[(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl]sulfanyl-6-methoxypyrimidin-4-olate Traditional Name: 2-[[(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl]thio]-6-methoxy-pyrimidin-4-olate Formula: C14H20N3O3S- MolecularWeight: 310.3919

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)SC2=NC(=CC(=N2)OC)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1CCCCC1)SC2=NC(=CC(=N2)OC)[O-]

InChI

InChI=1S/C14H21N3O3S/c1-9(13(19)15-10-6-4-3-5-7-10)21-14-16-11(18)8-12(17-14)20-2/h8-10H,3-7H2,1-2H3,(H,15,19)(H,16,17,18)/p-1/t9-/m1/s1