ethyl 4-[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]piperazine-1-carboxylate CAS Name: 4-[amino-[(4,6-dimethyl-2-pyrimidinyl)imino]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]piperazine-1-carboxylate Traditional Name: 4-[N'-(4,6-dimethylpyrimidin-2-yl)amidino]piperazine-1-carboxylic acid ethyl ester Formula: C14H22N6O2 MolecularWeight: 306.36348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=NC2=NC(=CC(=N2)C)C)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=NC2=NC(=CC(=N2)C)C)N

InChI

InChI=1S/C14H22N6O2/c1-4-22-14(21)20-7-5-19(6-8-20)12(15)18-13-16-10(2)9-11(3)17-13/h9H,4-8H2,1-3H3,(H2,15,16,17,18)