2-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC=C1)OCCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

Isomeric SMILES

CN(C)CC1=CC(=CC=C1)OCCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

InChI

InChI=1S/C22H27N5O2/c1-27(2)16-18-6-3-8-20(13-18)29-11-5-10-24-22-25-15-19(21(28)26-22)12-17-7-4-9-23-14-17/h3-4,6-9,13-15H,5,10-12,16H2,1-2H3,(H2,24,25,26,28)