3-[4-methyl-6-oxidanylidene-2-(pyridin-2-ylamino)-1,3-diazinan-5-yl]propanoic acid

Systemtic Name: 3-[4-methyl-6-oxidanylidene-2-(pyridin-2-ylamino)-1,3-diazinan-5-yl]propanoic acid Openeye Name: 3-[4-methyl-6-oxo-2-(2-pyridylamino)hexahydropyrimidin-5-yl]propanoic acid CAS Name: 3-[4-methyl-6-oxo-2-(2-pyridinylamino)-1,3-diazinan-5-yl]propanoic acid IUPAC Name: 3-[4-methyl-6-oxo-2-(pyridin-2-ylamino)-1,3-diazinan-5-yl]propanoic acid Traditional Name: 3-[4-keto-6-methyl-2-(2-pyridylamino)hexahydropyrimidin-5-yl]propionic acid Formula: C13H18N4O3 MolecularWeight: 278.30702

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)NC(N1)NC2=CC=CC=N2)CCC(=O)O

Isomeric SMILES

CC1C(C(=O)NC(N1)NC2=CC=CC=N2)CCC(=O)O

InChI

InChI=1S/C13H18N4O3/c1-8-9(5-6-11(18)19)12(20)17-13(15-8)16-10-4-2-3-7-14-10/h2-4,7-9,13,15H,5-6H2,1H3,(H,14,16)(H,17,20)(H,18,19)