sodium 5-[(2S)-pentan-2-yl]-5-prop-2-enyl-1,3-diazinane-2,4,6-trione

Systemtic Name: sodium 5-[(2S)-pentan-2-yl]-5-prop-2-enyl-1,3-diazinane-2,4,6-trione Openeye Name: sodium 5-allyl-5-[(1S)-1-methylbutyl]hexahydropyrimidine-2,4,6-trione CAS Name: sodium 5-[(2S)-pentan-2-yl]-5-prop-2-enyl-1,3-diazinane-2,4,6-trione IUPAC Name: sodium 5-[(2S)-pentan-2-yl]-5-prop-2-enyl-1,3-diazinane-2,4,6-trione Traditional Name: sodium 5-allyl-5-[(1S)-1-methylbutyl]barbituric acid Formula: C12H18N2NaO3+ MolecularWeight: 261.27269

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=O)NC(=O)NC1=O)CC=C.[Na+]

Isomeric SMILES

CCC[C@H](C)C1(C(=O)NC(=O)NC1=O)CC=C.[Na+]

InChI

InChI=1S/C12H18N2O3.Na/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16;/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17);/q;+1/t8-;/m0./s1