2-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxidanylidene-pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxidanylidene-pyrazin-1-yl]ethanoic acid Openeye Name: 2-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxo-pyrazin-1-yl]acetic acid CAS Name: 2-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxo-1-pyrazinyl]acetic acid IUPAC Name: 2-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]acetic acid Traditional Name: 2-[2-keto-6-methyl-3-[[(2S)-2-methylbutyl]amino]pyrazin-1-yl]acetic acid Formula: C12H19N3O3 MolecularWeight: 253.29756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC1=NC=C(N(C1=O)CC(=O)O)C

Isomeric SMILES

CC[C@H](C)CNC1=NC=C(N(C1=O)CC(=O)O)C

InChI

InChI=1S/C12H19N3O3/c1-4-8(2)5-13-11-12(18)15(7-10(16)17)9(3)6-14-11/h6,8H,4-5,7H2,1-3H3,(H,13,14)(H,16,17)/t8-/m0/s1