(2S)-1-[[3-[6-(3-methylpyrazin-2-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-[[3-[6-(3-methylpyrazin-2-yl)-4-oxidanylidene-1H-pyrimidin-2-yl]phenyl]methyl]pyrrolidine-2-carboxamide Openeye Name: (2S)-1-[[3-[6-(3-methylpyrazin-2-yl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-[[3-[6-(3-methyl-2-pyrazinyl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-[[3-[6-(3-methylpyrazin-2-yl)-4-oxo-1H-pyrimidin-2-yl]phenyl]methyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-[3-[4-keto-6-(3-methylpyrazin-2-yl)-1H-pyrimidin-2-yl]benzyl]pyrrolidine-2-carboxamide Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN=C1C2=CC(=O)N=C(N2)C3=CC(=CC=C3)CN4CCCC4C(=O)N

Isomeric SMILES

CC1=NC=CN=C1C2=CC(=O)N=C(N2)C3=CC(=CC=C3)CN4CCC[C@H]4C(=O)N

InChI

InChI=1S/C21H22N6O2/c1-13-19(24-8-7-23-13)16-11-18(28)26-21(25-16)15-5-2-4-14(10-15)12-27-9-3-6-17(27)20(22)29/h2,4-5,7-8,10-11,17H,3,6,9,12H2,1H3,(H2,22,29)(H,25,26,28)/t17-/m0/s1