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

Systemtic Name: 4-[2-[2-cyclopropylethyl(hydroxymethyl)amino]-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[2-[2-cyclopropylethyl(hydroxymethyl)amino]-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[2-[2-cyclopropylethyl(hydroxymethyl)amino]-5-methyl-4-pyrimidinyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[2-[2-cyclopropylethyl(hydroxymethyl)amino]-5-methylpyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[2-[2-cyclopropylethyl(methylol)amino]-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CNC(=C2)C(=O)O)N(CCC3CC3)CO

Isomeric SMILES

CC1=CN=C(N=C1C2=CNC(=C2)C(=O)O)N(CCC3CC3)CO

InChI

InChI=1S/C16H20N4O3/c1-10-7-18-16(20(9-21)5-4-11-2-3-11)19-14(10)12-6-13(15(22)23)17-8-12/h6-8,11,17,21H,2-5,9H2,1H3,(H,22,23)