sodium 5-(ethylsulfanylmethyl)-1-methyl-5-(2-methylpropyl)-4,6-bis(oxidanylidene)pyrimidin-2-olate

Systemtic Name: sodium 5-(ethylsulfanylmethyl)-1-methyl-5-(2-methylpropyl)-4,6-bis(oxidanylidene)pyrimidin-2-olate Openeye Name: sodium 5-(ethylsulfanylmethyl)-5-isobutyl-1-methyl-4,6-dioxo-pyrimidin-2-olate CAS Name: sodium 5-[(ethylthio)methyl]-1-methyl-5-(2-methylpropyl)-4,6-dioxo-2-pyrimidinolate IUPAC Name: sodium 5-(ethylsulfanylmethyl)-1-methyl-5-(2-methylpropyl)-4,6-dioxopyrimidin-2-olate Traditional Name: sodium 5-[(ethylthio)methyl]-5-isobutyl-4,6-diketo-1-methyl-pyrimidin-2-olate Formula: C12H19N2NaO3S MolecularWeight: 294.34563

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Descriptors Computed from Structure

Canonical SMILES:

CCSCC1(C(=O)N=C(N(C1=O)C)[O-])CC(C)C.[Na+]

Isomeric SMILES

CCSCC1(C(=O)N=C(N(C1=O)C)[O-])CC(C)C.[Na+]

InChI

InChI=1S/C12H20N2O3S.Na/c1-5-18-7-12(6-8(2)3)9(15)13-11(17)14(4)10(12)16;/h8H,5-7H2,1-4H3,(H,13,15,17);/q;+1/p-1