sodium 5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: sodium 5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: sodium 5-allyl-5-(1-methylbutyl)-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: sodium 5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: sodium 5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: sodium 5-allyl-5-(1-methylbutyl)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C12H18N2NaO2S+ MolecularWeight: 277.33829

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O2S.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