1-[[1-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]piperidin-4-yl]methyl]pyrrolidin-2-one

Systemtic Name: 1-[[1-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]piperidin-4-yl]methyl]pyrrolidin-2-one Openeye Name: 1-[[1-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]-4-piperidyl]methyl]pyrrolidin-2-one CAS Name: 1-[[1-[[1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methyl]-4-piperidinyl]methyl]-2-pyrrolidinone IUPAC Name: 1-[[1-[[1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methyl]piperidin-4-yl]methyl]pyrrolidin-2-one Traditional Name: 1-[[1-[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methyl]-4-piperidyl]methyl]-2-pyrrolidone Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)CN4CCC(CC4)CN5CCCC5=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=C(C(=N2)C3=CC=CC=C3)CN4CCC(CC4)CN5CCCC5=O

InChI

InChI=1S/C28H34N4O/c1-21-10-11-22(2)26(17-21)32-20-25(28(29-32)24-7-4-3-5-8-24)19-30-15-12-23(13-16-30)18-31-14-6-9-27(31)33/h3-5,7-8,10-11,17,20,23H,6,9,12-16,18-19H2,1-2H3