(2S)-2-azaniumyl-3-(4-azanyl-2-methyl-pyrimidin-5-yl)propanoate

Systemtic Name: (2S)-2-azaniumyl-3-(4-azanyl-2-methyl-pyrimidin-5-yl)propanoate Openeye Name: (2S)-3-(4-amino-2-methyl-pyrimidin-5-yl)-2-azaniumyl-propanoate CAS Name: (2S)-3-(4-amino-2-methyl-5-pyrimidinyl)-2-ammoniopropanoate IUPAC Name: (2S)-3-(4-amino-2-methylpyrimidin-5-yl)-2-azaniumylpropanoate Traditional Name: (2S)-3-(4-amino-2-methyl-pyrimidin-5-yl)-2-ammonio-propionate Formula: C8H12N4O2 MolecularWeight: 196.20648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)N)CC(C(=O)[O-])[NH3+]

Isomeric SMILES

CC1=NC=C(C(=N1)N)C[C@@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C8H12N4O2/c1-4-11-3-5(7(10)12-4)2-6(9)8(13)14/h3,6H,2,9H2,1H3,(H,13,14)(H2,10,11,12)/t6-/m0/s1