2-[[2-(3-azanylpropoxy)phenyl]methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[[2-(3-azanylpropoxy)phenyl]methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[[2-(3-aminopropoxy)phenyl]methylamino]-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[[2-(3-aminopropoxy)phenyl]methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-[[2-(3-aminopropoxy)phenyl]methylamino]-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[[2-(3-aminopropoxy)benzyl]amino]-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=NC(=O)C=C(N2)C3=CC=NC=C3)OCCCN

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=NC(=O)C=C(N2)C3=CC=NC=C3)OCCCN

InChI

InChI=1S/C19H21N5O2/c20-8-3-11-26-17-5-2-1-4-15(17)13-22-19-23-16(12-18(25)24-19)14-6-9-21-10-7-14/h1-2,4-7,9-10,12H,3,8,11,13,20H2,(H2,22,23,24,25)