ethyl 4-[[6-(2-chlorophenyl)-7-oxidanylidene-5,8-dihydropyrimido[4,5-d]pyrimidin-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[6-(2-chlorophenyl)-7-oxidanylidene-5,8-dihydropyrimido[4,5-d]pyrimidin-2-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[6-(2-chlorophenyl)-7-oxo-5,8-dihydropyrimido[4,5-d]pyrimidin-2-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[6-(2-chlorophenyl)-7-oxo-5,8-dihydropyrimido[4,5-d]pyrimidin-2-yl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[6-(2-chlorophenyl)-7-oxo-5,8-dihydropyrimido[4,5-d]pyrimidin-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[6-(2-chlorophenyl)-7-keto-5,8-dihydropyrimido[4,5-d]pyrimidin-2-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H23ClN6O3 MolecularWeight: 430.88802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC=C3CN(C(=O)NC3=N2)C4=CC=CC=C4Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC=C3CN(C(=O)NC3=N2)C4=CC=CC=C4Cl

InChI

InChI=1S/C20H23ClN6O3/c1-2-30-20(29)26-9-7-14(8-10-26)23-18-22-11-13-12-27(19(28)25-17(13)24-18)16-6-4-3-5-15(16)21/h3-6,11,14H,2,7-10,12H2,1H3,(H2,22,23,24,25,28)