2-[4-(4-carbonochloridoyl-3,5-dimethyl-piperazin-1-yl)pyrimidin-2-yl]ethyl butanoate

Systemtic Name: 2-[4-(4-carbonochloridoyl-3,5-dimethyl-piperazin-1-yl)pyrimidin-2-yl]ethyl butanoate Openeye Name: 2-[4-(4-chlorocarbonyl-3,5-dimethyl-piperazin-1-yl)pyrimidin-2-yl]ethyl butanoate CAS Name: butanoic acid 2-[4-(4-carbonochloridoyl-3,5-dimethyl-1-piperazinyl)-2-pyrimidinyl]ethyl ester IUPAC Name: 2-[4-(4-carbonochloridoyl-3,5-dimethylpiperazin-1-yl)pyrimidin-2-yl]ethyl butanoate Traditional Name: butyric acid 2-[4-(4-chlorocarbonyl-3,5-dimethyl-piperazino)pyrimidin-2-yl]ethyl ester Formula: C17H25ClN4O3 MolecularWeight: 368.8584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCC1=NC=CC(=N1)N2CC(N(C(C2)C)C(=O)Cl)C

Isomeric SMILES

CCCC(=O)OCCC1=NC=CC(=N1)N2CC(N(C(C2)C)C(=O)Cl)C

InChI

InChI=1S/C17H25ClN4O3/c1-4-5-16(23)25-9-7-14-19-8-6-15(20-14)21-10-12(2)22(17(18)24)13(3)11-21/h6,8,12-13H,4-5,7,9-11H2,1-3H3