6-methyl-3-(methylamino)-1-(pyrazin-2-ylmethyl)azepan-2-one

Systemtic Name: 6-methyl-3-(methylamino)-1-(pyrazin-2-ylmethyl)azepan-2-one Openeye Name: 6-methyl-3-(methylamino)-1-(pyrazin-2-ylmethyl)azepan-2-one CAS Name: 6-methyl-3-(methylamino)-1-(2-pyrazinylmethyl)-2-azepanone IUPAC Name: 6-methyl-3-(methylamino)-1-(pyrazin-2-ylmethyl)azepan-2-one Traditional Name: 6-methyl-3-(methylamino)-1-(pyrazin-2-ylmethyl)azepan-2-one Formula: C13H20N4O MolecularWeight: 248.3241

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)N(C1)CC2=NC=CN=C2)NC

Isomeric SMILES

CC1CCC(C(=O)N(C1)CC2=NC=CN=C2)NC

InChI

InChI=1S/C13H20N4O/c1-10-3-4-12(14-2)13(18)17(8-10)9-11-7-15-5-6-16-11/h5-7,10,12,14H,3-4,8-9H2,1-2H3