2-[cyclohexyl(methyl)amino]-4-(2-phenoxyethylamino)pyrimidine-5-carboxylic acid

Systemtic Name: 2-[cyclohexyl(methyl)amino]-4-(2-phenoxyethylamino)pyrimidine-5-carboxylic acid Openeye Name: 2-[cyclohexyl(methyl)amino]-4-(2-phenoxyethylamino)pyrimidine-5-carboxylic acid CAS Name: 2-[cyclohexyl(methyl)amino]-4-(2-phenoxyethylamino)-5-pyrimidinecarboxylic acid IUPAC Name: 2-[cyclohexyl(methyl)amino]-4-(2-phenoxyethylamino)pyrimidine-5-carboxylic acid Traditional Name: 2-[cyclohexyl(methyl)amino]-4-(2-phenoxyethylamino)pyrimidine-5-carboxylic acid Formula: C20H26N4O3 MolecularWeight: 370.44544

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=NC=C(C(=N2)NCCOC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN(C1CCCCC1)C2=NC=C(C(=N2)NCCOC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H26N4O3/c1-24(15-8-4-2-5-9-15)20-22-14-17(19(25)26)18(23-20)21-12-13-27-16-10-6-3-7-11-16/h3,6-7,10-11,14-15H,2,4-5,8-9,12-13H2,1H3,(H,25,26)(H,21,22,23)