1-(2-methylpropyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(2-methylpropyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-isobutyl-5-(pyrimidin-5-ylmethyl)-2-thioxo-pyrimidin-4-one CAS Name: 1-(2-methylpropyl)-5-(5-pyrimidinylmethyl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(2-methylpropyl)-5-(pyrimidin-5-ylmethyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-isobutyl-5-(5-pyrimidylmethyl)-2-thioxo-pyrimidin-4-one Formula: C13H16N4OS MolecularWeight: 276.35734

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4OS/c1-9(2)6-17-7-11(12(18)16-13(17)19)3-10-4-14-8-15-5-10/h4-5,7-9H,3,6H2,1-2H3,(H,16,18,19)