4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-(3,4,5-trimethoxyphenyl)pyrrolidin-2-one

Systemtic Name: 4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-1-(3,4,5-trimethoxyphenyl)pyrrolidin-2-one Openeye Name: 4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-1-(3,4,5-trimethoxyphenyl)pyrrolidin-2-one CAS Name: 4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1-(3,4,5-trimethoxyphenyl)-2-pyrrolidinone IUPAC Name: 4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-1-(3,4,5-trimethoxyphenyl)pyrrolidin-2-one Traditional Name: 4-[4-(2-pyrimidyl)piperazine-1-carbonyl]-1-(3,4,5-trimethoxyphenyl)-2-pyrrolidone Formula: C22H27N5O5 MolecularWeight: 441.48028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C22H27N5O5/c1-30-17-12-16(13-18(31-2)20(17)32-3)27-14-15(11-19(27)28)21(29)25-7-9-26(10-8-25)22-23-5-4-6-24-22/h4-6,12-13,15H,7-11,14H2,1-3H3