4-(2-methylpropylamino)pyrimidine-5-carboxylate

Systemtic Name: 4-(2-methylpropylamino)pyrimidine-5-carboxylate Openeye Name: 4-(isobutylamino)pyrimidine-5-carboxylate CAS Name: 4-(2-methylpropylamino)-5-pyrimidinecarboxylate IUPAC Name: 4-(2-methylpropylamino)pyrimidine-5-carboxylate Traditional Name: 4-(isobutylamino)pyrimidine-5-carboxylate Formula: C9H12N3O2- MolecularWeight: 194.21048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC=NC=C1C(=O)[O-]

Isomeric SMILES

CC(C)CNC1=NC=NC=C1C(=O)[O-]

InChI

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