1-(2,2-dimethylpropyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(2,2-dimethylpropyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(2,2-dimethylpropyl)-5-(pyrimidin-5-ylmethyl)-2-thioxo-pyrimidin-4-one CAS Name: 1-(2,2-dimethylpropyl)-5-(5-pyrimidinylmethyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(2,2-dimethylpropyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-neopentyl-5-(5-pyrimidylmethyl)-2-thioxo-pyrimidin-4-one Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C=C(C(=O)NC1=S)CC2=CN=CN=C2

Isomeric SMILES

CC(C)(C)CN1C=C(C(=O)NC1=S)CC2=CN=CN=C2

InChI

InChI=1S/C14H18N4OS/c1-14(2,3)8-18-7-11(12(19)17-13(18)20)4-10-5-15-9-16-6-10/h5-7,9H,4,8H2,1-3H3,(H,17,19,20)