2-azanyl-6-methyl-5-(3-methylbutyl)-3-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 2-azanyl-6-methyl-5-(3-methylbutyl)-3-(phenylmethyl)pyrimidin-4-one Openeye Name: 2-amino-3-benzyl-5-isopentyl-6-methyl-pyrimidin-4-one CAS Name: 2-amino-6-methyl-5-(3-methylbutyl)-3-(phenylmethyl)-4-pyrimidinone IUPAC Name: 2-amino-3-benzyl-6-methyl-5-(3-methylbutyl)pyrimidin-4-one Traditional Name: 2-amino-3-benzyl-5-isoamyl-6-methyl-pyrimidin-4-one Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)N)CC2=CC=CC=C2)CCC(C)C

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)N)CC2=CC=CC=C2)CCC(C)C

InChI

InChI=1S/C17H23N3O/c1-12(2)9-10-15-13(3)19-17(18)20(16(15)21)11-14-7-5-4-6-8-14/h4-8,12H,9-11H2,1-3H3,(H2,18,19)