6-(2-azanylethyl)-2-[4-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-(2-azanylethyl)-2-[4-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Openeye Name: 6-(2-aminoethyl)-2-[4-[[cyclopropyl(4-pyridylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one CAS Name: 6-(2-aminoethyl)-2-[4-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-(2-aminoethyl)-2-[4-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Traditional Name: 6-(2-aminoethyl)-2-[4-[[cyclopropyl(4-pyridylmethyl)amino]methyl]phenyl]-1H-pyrimidin-4-one Formula: C22H25N5O MolecularWeight: 375.4668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)CCN)CC4=CC=NC=C4

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)C3=NC(=O)C=C(N3)CCN)CC4=CC=NC=C4

InChI

InChI=1S/C22H25N5O/c23-10-7-19-13-21(28)26-22(25-19)18-3-1-16(2-4-18)14-27(20-5-6-20)15-17-8-11-24-12-9-17/h1-4,8-9,11-13,20H,5-7,10,14-15,23H2,(H,25,26,28)