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

Systemtic Name: 4-(2-methylpropylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: 4-(isobutylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-(2-methylpropylamino)-2-(methylthio)-5-pyrimidinecarboxylate IUPAC Name: 4-(2-methylpropylamino)-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-(isobutylamino)-2-(methylthio)pyrimidine-5-carboxylate Formula: C10H14N3O2S- MolecularWeight: 240.30206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H15N3O2S/c1-6(2)4-11-8-7(9(14)15)5-12-10(13-8)16-3/h5-6H,4H2,1-3H3,(H,14,15)(H,11,12,13)/p-1