ethyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[2-[(3-methoxyphenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[4-keto-2-(m-anisylthio)-6-methyl-1H-pyrimidin-5-yl]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CC2=C(NC(=NC2=O)SCC3=CC(=CC=C3)OC)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CC2=C(NC(=NC2=O)SCC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C22H28N4O5S/c1-4-31-22(29)26-10-8-25(9-11-26)19(27)13-18-15(2)23-21(24-20(18)28)32-14-16-6-5-7-17(12-16)30-3/h5-7,12H,4,8-11,13-14H2,1-3H3,(H,23,24,28)