1-azanyl-2-[2-(3-tert-butyl-4-oxidanyl-phenyl)ethyl]-6-methyl-pyrimidin-4-one

Systemtic Name: 1-azanyl-2-[2-(3-tert-butyl-4-oxidanyl-phenyl)ethyl]-6-methyl-pyrimidin-4-one Openeye Name: 1-amino-2-[2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]-6-methyl-pyrimidin-4-one CAS Name: 1-amino-2-[2-(3-tert-butyl-4-hydroxyphenyl)ethyl]-6-methyl-4-pyrimidinone IUPAC Name: 1-amino-2-[2-(3-tert-butyl-4-hydroxyphenyl)ethyl]-6-methylpyrimidin-4-one Traditional Name: 1-amino-2-[2-(3-tert-butyl-4-hydroxy-phenyl)ethyl]-6-methyl-pyrimidin-4-one Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1N)CCC2=CC(=C(C=C2)O)C(C)(C)C

Isomeric SMILES

CC1=CC(=O)N=C(N1N)CCC2=CC(=C(C=C2)O)C(C)(C)C

InChI

InChI=1S/C17H23N3O2/c1-11-9-16(22)19-15(20(11)18)8-6-12-5-7-14(21)13(10-12)17(2,3)4/h5,7,9-10,21H,6,8,18H2,1-4H3