2-[(2R)-1-[[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[(2R)-1-[[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl]amino]-1-oxidanylidene-butan-2-yl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[(1R)-1-[[(1R)-2-methoxy-2-oxo-1-phenyl-ethyl]carbamoyl]propyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[(2R)-1-[[(1R)-2-methoxy-2-oxo-1-phenylethyl]amino]-1-oxobutan-2-yl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[(2R)-1-[[(1R)-2-methoxy-2-oxo-1-phenylethyl]amino]-1-oxobutan-2-yl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[(1R)-1-[[(1R)-2-keto-2-methoxy-1-phenyl-ethyl]carbamoyl]propyl]thio]-6-methyl-pyrimidin-4-olate Formula: C18H20N3O4S- MolecularWeight: 374.4341

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C1=CC=CC=C1)C(=O)OC)SC2=NC(=CC(=N2)[O-])C

Isomeric SMILES

CC[C@H](C(=O)N[C@H](C1=CC=CC=C1)C(=O)OC)SC2=NC(=CC(=N2)[O-])C

InChI

InChI=1S/C18H21N3O4S/c1-4-13(26-18-19-11(2)10-14(22)20-18)16(23)21-15(17(24)25-3)12-8-6-5-7-9-12/h5-10,13,15H,4H2,1-3H3,(H,21,23)(H,19,20,22)/p-1/t13-,15-/m1/s1