2-[(phenylmethyl)-(2-pyridin-2-ylethyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 2-[(phenylmethyl)-(2-pyridin-2-ylethyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 2-[benzyl-[2-(2-pyridyl)ethyl]amino]-6-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 2-[(phenylmethyl)-[2-(2-pyridinyl)ethyl]amino]-6-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 2-[benzyl(2-pyridin-2-ylethyl)amino]-6-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 2-[benzyl-[2-(2-pyridyl)ethyl]amino]-6-(4-pyridyl)-1H-pyrimidin-4-one Formula: C23H21N5O MolecularWeight: 383.44574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC2=CC=CC=N2)C3=NC(=O)C=C(N3)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC2=CC=CC=N2)C3=NC(=O)C=C(N3)C4=CC=NC=C4

InChI

InChI=1S/C23H21N5O/c29-22-16-21(19-9-13-24-14-10-19)26-23(27-22)28(17-18-6-2-1-3-7-18)15-11-20-8-4-5-12-25-20/h1-10,12-14,16H,11,15,17H2,(H,26,27,29)