5-methyl-6-(2-methylpropyl)-3-(phenylmethyl)-1H-pyrazin-2-one

Systemtic Name: 5-methyl-6-(2-methylpropyl)-3-(phenylmethyl)-1H-pyrazin-2-one Openeye Name: 3-benzyl-6-isobutyl-5-methyl-1H-pyrazin-2-one CAS Name: 5-methyl-6-(2-methylpropyl)-3-(phenylmethyl)-1H-pyrazin-2-one IUPAC Name: 3-benzyl-5-methyl-6-(2-methylpropyl)-1H-pyrazin-2-one Traditional Name: 3-benzyl-6-isobutyl-5-methyl-1H-pyrazin-2-one Formula: C16H20N2O MolecularWeight: 256.3428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C(=N1)CC2=CC=CC=C2)CC(C)C

Isomeric SMILES

CC1=C(NC(=O)C(=N1)CC2=CC=CC=C2)CC(C)C

InChI

InChI=1S/C16H20N2O/c1-11(2)9-14-12(3)17-15(16(19)18-14)10-13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,18,19)