ethyl 4-[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(5-chloranylpyridin-2-yl)amino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-[(5-chloro-2-pyridyl)amino]-1-methyl-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[1-[(5-chloro-2-pyridinyl)amino]-1-oxopropan-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(5-chloropyridin-2-yl)amino]-1-oxopropan-2-yl]piperazine-1-carboxylate Traditional Name: 4-[2-[(5-chloro-2-pyridyl)amino]-2-keto-1-methyl-ethyl]piperazine-1-carboxylic acid ethyl ester Formula: C15H21ClN4O3 MolecularWeight: 340.80524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(C)C(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C15H21ClN4O3/c1-3-23-15(22)20-8-6-19(7-9-20)11(2)14(21)18-13-5-4-12(16)10-17-13/h4-5,10-11H,3,6-9H2,1-2H3,(H,17,18,21)