4-[2-[hydroxymethyl(propyl)amino]-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 4-[2-[hydroxymethyl(propyl)amino]-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[2-[hydroxymethyl(propyl)amino]-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[2-[hydroxymethyl(propyl)amino]-5-methyl-4-pyrimidinyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[2-[hydroxymethyl(propyl)amino]-5-methylpyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[5-methyl-2-[methylol(propyl)amino]pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Formula: C14H18N4O3 MolecularWeight: 290.31772

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CO)C1=NC=C(C(=N1)C2=CNC(=C2)C(=O)O)C

Isomeric SMILES

CCCN(CO)C1=NC=C(C(=N1)C2=CNC(=C2)C(=O)O)C

InChI

InChI=1S/C14H18N4O3/c1-3-4-18(8-19)14-16-6-9(2)12(17-14)10-5-11(13(20)21)15-7-10/h5-7,15,19H,3-4,8H2,1-2H3,(H,20,21)