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

Systemtic Name: 2-[(2R)-1-(cyclohexylcarbamoylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-6-propyl-pyrimidin-4-olate Openeye Name: 2-[(1R)-2-(cyclohexylcarbamoylamino)-1-methyl-2-oxo-ethyl]sulfanyl-6-propyl-pyrimidin-4-olate CAS Name: 2-[[(2R)-1-[[(cyclohexylamino)-oxomethyl]amino]-1-oxopropan-2-yl]thio]-6-propyl-4-pyrimidinolate IUPAC Name: 2-[(2R)-1-(cyclohexylcarbamoylamino)-1-oxopropan-2-yl]sulfanyl-6-propylpyrimidin-4-olate Traditional Name: 2-[[(1R)-2-(cyclohexylcarbamoylamino)-2-keto-1-methyl-ethyl]thio]-6-propyl-pyrimidin-4-olate Formula: C17H25N4O3S- MolecularWeight: 365.4704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)SC(C)C(=O)NC(=O)NC2CCCCC2)[O-]

Isomeric SMILES

CCCC1=CC(=NC(=N1)S[C@H](C)C(=O)NC(=O)NC2CCCCC2)[O-]

InChI

InChI=1S/C17H26N4O3S/c1-3-7-13-10-14(22)20-17(19-13)25-11(2)15(23)21-16(24)18-12-8-5-4-6-9-12/h10-12H,3-9H2,1-2H3,(H,19,20,22)(H2,18,21,23,24)/p-1/t11-/m1/s1