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

Systemtic Name: methyl 1-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxidanylidene-1H-pyrimidin-5-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[2-[(3-methoxyphenyl)methylthio]-6-methyl-4-oxo-1H-pyrimidin-5-yl]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[2-[(3-methoxyphenyl)methylsulfanyl]-6-methyl-4-oxo-1H-pyrimidin-5-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-keto-2-(m-anisylthio)-6-methyl-1H-pyrimidin-5-yl]acetyl]isonipecotic acid methyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)OC)CC(=O)N3CCC(CC3)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC2=CC(=CC=C2)OC)CC(=O)N3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H27N3O5S/c1-14-18(12-19(26)25-9-7-16(8-10-25)21(28)30-3)20(27)24-22(23-14)31-13-15-5-4-6-17(11-15)29-2/h4-6,11,16H,7-10,12-13H2,1-3H3,(H,23,24,27)