1,3-diethyl-6-oxidanyl-2-sulfanylidene-5-[2-(1,2,4-triazol-1-yl)ethanoyl]pyrimidin-4-one

Systemtic Name: 1,3-diethyl-6-oxidanyl-2-sulfanylidene-5-[2-(1,2,4-triazol-1-yl)ethanoyl]pyrimidin-4-one Openeye Name: 1,3-diethyl-6-hydroxy-2-thioxo-5-[2-(1,2,4-triazol-1-yl)acetyl]pyrimidin-4-one CAS Name: 1,3-diethyl-6-hydroxy-5-[1-oxo-2-(1,2,4-triazol-1-yl)ethyl]-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1,3-diethyl-6-hydroxy-2-sulfanylidene-5-[2-(1,2,4-triazol-1-yl)acetyl]pyrimidin-4-one Traditional Name: 1,3-diethyl-6-hydroxy-2-thioxo-5-[2-(1,2,4-triazol-1-yl)acetyl]pyrimidin-4-one Formula: C12H15N5O3S MolecularWeight: 309.3442

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=O)N(C1=S)CC)C(=O)CN2C=NC=N2)O

Isomeric SMILES

CCN1C(=C(C(=O)N(C1=S)CC)C(=O)CN2C=NC=N2)O

InChI

InChI=1S/C12H15N5O3S/c1-3-16-10(19)9(11(20)17(4-2)12(16)21)8(18)5-15-7-13-6-14-15/h6-7,19H,3-5H2,1-2H3