2-[4-[[(2S)-2-(imidazol-1-ylmethyl)pyrrolidin-1-yl]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[4-[[(2S)-2-(imidazol-1-ylmethyl)pyrrolidin-1-yl]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[4-[[(2S)-2-(imidazol-1-ylmethyl)pyrrolidin-1-yl]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[4-[[(2S)-2-(1-imidazolylmethyl)-1-pyrrolidinyl]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[4-[[(2S)-2-(imidazol-1-ylmethyl)pyrrolidin-1-yl]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[4-[[(2S)-2-(imidazol-1-ylmethyl)pyrrolidino]methyl]phenyl]-6-propyl-1H-pyrimidin-4-one Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)C2=CC=C(C=C2)CN3CCCC3CN4C=CN=C4

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)C2=CC=C(C=C2)CN3CCC[C@H]3CN4C=CN=C4

InChI

InChI=1S/C22H27N5O/c1-2-4-19-13-21(28)25-22(24-19)18-8-6-17(7-9-18)14-27-11-3-5-20(27)15-26-12-10-23-16-26/h6-10,12-13,16,20H,2-5,11,14-15H2,1H3,(H,24,25,28)/t20-/m0/s1