1,3-diethyl-5-(2-imidazol-1-ylethanoyl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1,3-diethyl-5-(2-imidazol-1-ylethanoyl)-6-oxidanyl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1,3-diethyl-6-hydroxy-5-(2-imidazol-1-ylacetyl)-2-thioxo-pyrimidin-4-one CAS Name: 1,3-diethyl-6-hydroxy-5-[2-(1-imidazolyl)-1-oxoethyl]-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1,3-diethyl-6-hydroxy-5-(2-imidazol-1-ylacetyl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1,3-diethyl-6-hydroxy-5-(2-imidazol-1-ylacetyl)-2-thioxo-pyrimidin-4-one Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N(C1=S)CC)C(=O)CN2C=CN=C2)O

Isomeric SMILES

CCN1C(=C(C(=O)N(C1=S)CC)C(=O)CN2C=CN=C2)O

InChI

InChI=1S/C13H16N4O3S/c1-3-16-11(19)10(12(20)17(4-2)13(16)21)9(18)7-15-6-5-14-8-15/h5-6,8,19H,3-4,7H2,1-2H3