2-[4-[propyl(pyridin-2-yl)amino]butylamino]-5-(pyridin-4-ylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[4-[propyl(pyridin-2-yl)amino]butylamino]-5-(pyridin-4-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[4-[propyl(2-pyridyl)amino]butylamino]-5-(4-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[4-[propyl(2-pyridinyl)amino]butylamino]-5-(pyridin-4-ylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[4-[propyl(pyridin-2-yl)amino]butylamino]-5-(pyridin-4-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[4-[propyl(2-pyridyl)amino]butylamino]-5-(4-pyridylmethyl)-1H-pyrimidin-6-one Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCCNC1=NC=C(C(=O)N1)CC2=CC=NC=C2)C3=CC=CC=N3

Isomeric SMILES

CCCN(CCCCNC1=NC=C(C(=O)N1)CC2=CC=NC=C2)C3=CC=CC=N3

InChI

InChI=1S/C22H28N6O/c1-2-14-28(20-7-3-4-10-24-20)15-6-5-11-25-22-26-17-19(21(29)27-22)16-18-8-12-23-13-9-18/h3-4,7-10,12-13,17H,2,5-6,11,14-16H2,1H3,(H2,25,26,27,29)