2-azanyl-6-[2-[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]ethyl]-3-methyl-pyrimidin-4-one

Systemtic Name: 2-azanyl-6-[2-[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]ethyl]-3-methyl-pyrimidin-4-one Openeye Name: 2-amino-6-[2-[3-(2,3-dihydrobenzofuran-5-yl)phenyl]ethyl]-3-methyl-pyrimidin-4-one CAS Name: 2-amino-6-[2-[3-(2,3-dihydrobenzofuran-5-yl)phenyl]ethyl]-3-methyl-4-pyrimidinone IUPAC Name: 2-amino-6-[2-[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]ethyl]-3-methylpyrimidin-4-one Traditional Name: 2-amino-6-[2-(3-coumaran-5-ylphenyl)ethyl]-3-methyl-pyrimidin-4-one Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C=C(N=C1N)CCC2=CC=CC(=C2)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

CN1C(=O)C=C(N=C1N)CCC2=CC=CC(=C2)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C21H21N3O2/c1-24-20(25)13-18(23-21(24)22)7-5-14-3-2-4-15(11-14)16-6-8-19-17(12-16)9-10-26-19/h2-4,6,8,11-13H,5,7,9-10H2,1H3,(H2,22,23)