2-[5-azanylpentyl(phenethyl)amino]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[5-azanylpentyl(phenethyl)amino]-3-methyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[5-aminopentyl(phenethyl)amino]-3-methyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[5-aminopentyl(phenethyl)amino]-3-methyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[5-aminopentyl(phenethyl)amino]-3-methyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[5-aminopentyl(phenethyl)amino]-3-methyl-6-(4-pyridyl)pyrimidin-4-one Formula: C23H29N5O MolecularWeight: 391.50926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N(CCCCCN)CCC2=CC=CC=C2)C3=CC=NC=C3

Isomeric SMILES

CN1C(=O)C=C(N=C1N(CCCCCN)CCC2=CC=CC=C2)C3=CC=NC=C3

InChI

InChI=1S/C23H29N5O/c1-27-22(29)18-21(20-10-14-25-15-11-20)26-23(27)28(16-7-3-6-13-24)17-12-19-8-4-2-5-9-19/h2,4-5,8-11,14-15,18H,3,6-7,12-13,16-17,24H2,1H3