6-oxidanylidene-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 6-oxidanylidene-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 5-allyl-5-(1-methylbutyl)-6-oxo-2-thioxo-pyrimidin-4-olate CAS Name: 6-oxo-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 6-oxo-5-pentan-2-yl-5-prop-2-enyl-2-sulfanylidenepyrimidin-4-olate Traditional Name: 5-allyl-6-keto-5-(1-methylbutyl)-2-thioxo-pyrimidin-4-olate Formula: C12H17N2O2S- MolecularWeight: 253.34058

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1(C(=O)NC(=S)N=C1[O-])CC=C

Isomeric SMILES

CCCC(C)C1(C(=O)NC(=S)N=C1[O-])CC=C

InChI

InChI=1S/C12H18N2O2S/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)/p-1