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

Systemtic Name: 4-[2-(2-diethylaminoethylamino)-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Openeye Name: 4-[2-(2-diethylaminoethylamino)-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid CAS Name: 4-[2-(2-diethylaminoethylamino)-5-methyl-4-pyrimidinyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 4-[2-(2-diethylaminoethylamino)-5-methylpyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Traditional Name: 4-[2-(2-diethylaminoethylamino)-5-methyl-pyrimidin-4-yl]-1H-pyrrole-2-carboxylic acid Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=NC=C(C(=N1)C2=CNC(=C2)C(=O)O)C

Isomeric SMILES

CCN(CC)CCNC1=NC=C(C(=N1)C2=CNC(=C2)C(=O)O)C

InChI

InChI=1S/C16H23N5O2/c1-4-21(5-2)7-6-17-16-19-9-11(3)14(20-16)12-8-13(15(22)23)18-10-12/h8-10,18H,4-7H2,1-3H3,(H,22,23)(H,17,19,20)