(4S)-1-(2-ethoxyphenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyrrolidin-2-one

Systemtic Name: (4S)-1-(2-ethoxyphenyl)-4-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-pyrrolidin-2-one Openeye Name: (4S)-1-(2-ethoxyphenyl)-4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one CAS Name: (4S)-1-(2-ethoxyphenyl)-4-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-pyrrolidinone IUPAC Name: (4S)-1-(2-ethoxyphenyl)-4-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyrrolidin-2-one Traditional Name: (4S)-1-o-phenetyl-4-[4-(2-pyrimidyl)piperazine-1-carbonyl]-2-pyrrolidone Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC(CC2=O)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CCOC1=CC=CC=C1N2C[C@H](CC2=O)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H25N5O3/c1-2-29-18-7-4-3-6-17(18)26-15-16(14-19(26)27)20(28)24-10-12-25(13-11-24)21-22-8-5-9-23-21/h3-9,16H,2,10-15H2,1H3/t16-/m0/s1