5-(1,1-dicyano-3-methyl-butan-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate; morpholin-4-ium

Systemtic Name: 5-(1,1-dicyano-3-methyl-butan-2-yl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-olate; morpholin-4-ium Openeye Name: 5-[1-(dicyanomethyl)-2-methyl-propyl]-4-oxo-2-thioxo-1H-pyrimidin-6-olate; morpholin-4-ium CAS Name: 5-(1,1-dicyano-3-methylbutan-2-yl)-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate; morpholin-4-ium IUPAC Name: 5-(1,1-dicyano-3-methylbutan-2-yl)-4-oxo-2-sulfanylidene-1H-pyrimidin-6-olate; morpholin-4-ium Traditional Name: 5-[1-(dicyanomethyl)-2-methyl-propyl]-4-keto-2-thioxo-1H-pyrimidin-6-olate; morpholin-4-ium Formula: C15H21N5O3S MolecularWeight: 351.42394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C(NC(=S)NC1=O)[O-])C(C#N)C#N.C1COCC[NH2+]1

Isomeric SMILES

CC(C)C(C1=C(NC(=S)NC1=O)[O-])C(C#N)C#N.C1COCC[NH2+]1

InChI

InChI=1S/C11H12N4O2S.C4H9NO/c1-5(2)7(6(3-12)4-13)8-9(16)14-11(18)15-10(8)17;1-3-6-4-2-5-1/h5-7H,1-2H3,(H3,14,15,16,17,18);5H,1-4H2