ethyl 4-[2-oxidanylidene-2-[[4-[(4-pyridin-2-ylpyrimidin-2-yl)amino]phenyl]amino]ethyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[[4-[(4-pyridin-2-ylpyrimidin-2-yl)amino]phenyl]amino]ethyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-oxo-2-[4-[[4-(2-pyridyl)pyrimidin-2-yl]amino]anilino]ethyl]piperazine-1-carboxylate CAS Name: 4-[2-oxo-2-[4-[[4-(2-pyridinyl)-2-pyrimidinyl]amino]anilino]ethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-[4-[(4-pyridin-2-ylpyrimidin-2-yl)amino]anilino]ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-keto-2-[4-[[4-(2-pyridyl)pyrimidin-2-yl]amino]anilino]ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C24H27N7O3 MolecularWeight: 461.51628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC(=O)NC2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C24H27N7O3/c1-2-34-24(33)31-15-13-30(14-16-31)17-22(32)27-18-6-8-19(9-7-18)28-23-26-12-10-21(29-23)20-5-3-4-11-25-20/h3-12H,2,13-17H2,1H3,(H,27,32)(H,26,28,29)