ethyl 4-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoylamino]piperidine-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC(=CC=C3)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C22H28N4O5S/c1-3-31-22(29)26-9-7-16(8-10-26)23-19(27)12-17-13-20(28)25-21(24-17)32-14-15-5-4-6-18(11-15)30-2/h4-6,11,13,16H,3,7-10,12,14H2,1-2H3,(H,23,27)(H,24,25,28)