ethyl 4-[2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[(6-ethyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(6-ethyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(6-ethyl-4-keto-1H-pyrimidin-2-yl)thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H22N4O4S MolecularWeight: 354.42458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=O)N=C(N1)SCC(=O)N2CCN(CC2)C(=O)OCC

InChI

InChI=1S/C15H22N4O4S/c1-3-11-9-12(20)17-14(16-11)24-10-13(21)18-5-7-19(8-6-18)15(22)23-4-2/h9H,3-8,10H2,1-2H3,(H,16,17,20)