[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate

Systemtic Name: [2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-[(4-chloranylpyridin-2-yl)carbonylamino]ethanoate Openeye Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate CAS Name: 2-[[(4-chloro-2-pyridinyl)-oxomethyl]amino]acetic acid [2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl] 2-[(4-chloropyridine-2-carbonyl)amino]acetate Traditional Name: 2-[(4-chloropicolinoyl)amino]acetic acid [2-keto-2-[4-(2-pyrimidyl)piperazino]ethyl] ester Formula: C18H19ClN6O4 MolecularWeight: 418.83426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)CNC(=O)C3=NC=CC(=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC(=O)CNC(=O)C3=NC=CC(=C3)Cl

InChI

InChI=1S/C18H19ClN6O4/c19-13-2-5-20-14(10-13)17(28)23-11-16(27)29-12-15(26)24-6-8-25(9-7-24)18-21-3-1-4-22-18/h1-5,10H,6-9,11-12H2,(H,23,28)