2-[4-[4-(4-chloranyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-2,6-dimethyl-piperazin-1-yl]pyrimidin-2-yl]ethyl butanoate

Systemtic Name: 2-[4-[4-(4-chloranyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)-2,6-dimethyl-piperazin-1-yl]pyrimidin-2-yl]ethyl butanoate Openeye Name: 2-[4-[4-(4-chloro-6-morpholino-1,3,5-triazin-2-yl)-2,6-dimethyl-piperazin-1-yl]pyrimidin-2-yl]ethyl butanoate CAS Name: butanoic acid 2-[4-[4-[4-chloro-6-(4-morpholinyl)-1,3,5-triazin-2-yl]-2,6-dimethyl-1-piperazinyl]-2-pyrimidinyl]ethyl ester IUPAC Name: 2-[4-[4-(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)-2,6-dimethylpiperazin-1-yl]pyrimidin-2-yl]ethyl butanoate Traditional Name: butyric acid 2-[4-[4-(4-chloro-6-morpholino-s-triazin-2-yl)-2,6-dimethyl-piperazino]pyrimidin-2-yl]ethyl ester Formula: C23H33ClN8O3 MolecularWeight: 505.01292

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCCC1=NC=CC(=N1)N2C(CN(CC2C)C3=NC(=NC(=N3)N4CCOCC4)Cl)C

Isomeric SMILES

CCCC(=O)OCCC1=NC=CC(=N1)N2C(CN(CC2C)C3=NC(=NC(=N3)N4CCOCC4)Cl)C

InChI

InChI=1S/C23H33ClN8O3/c1-4-5-20(33)35-11-7-18-25-8-6-19(26-18)32-16(2)14-31(15-17(32)3)23-28-21(24)27-22(29-23)30-9-12-34-13-10-30/h6,8,16-17H,4-5,7,9-15H2,1-3H3