2-[[(2S)-butan-2-yl]amino]pyrimidine-5-carboxylate

Systemtic Name: 2-[[(2S)-butan-2-yl]amino]pyrimidine-5-carboxylate Openeye Name: 2-[[(1S)-1-methylpropyl]amino]pyrimidine-5-carboxylate CAS Name: 2-[[(2S)-butan-2-yl]amino]-5-pyrimidinecarboxylate IUPAC Name: 2-[[(2S)-butan-2-yl]amino]pyrimidine-5-carboxylate Traditional Name: 2-[[(1S)-1-methylpropyl]amino]pyrimidine-5-carboxylate Formula: C9H12N3O2- MolecularWeight: 194.21048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=NC=C(C=N1)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)NC1=NC=C(C=N1)C(=O)[O-]

InChI

InChI=1S/C9H13N3O2/c1-3-6(2)12-9-10-4-7(5-11-9)8(13)14/h4-6H,3H2,1-2H3,(H,13,14)(H,10,11,12)/p-1/t6-/m0/s1