ethyl N-[6-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1H-pyrimidin-5-yl]carbamate

Systemtic Name: ethyl N-[6-oxidanylidene-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1H-pyrimidin-5-yl]carbamate Openeye Name: ethyl N-[6-oxo-2-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]-1H-pyrimidin-5-yl]carbamate CAS Name: N-[6-oxo-2-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-1H-pyrimidin-5-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-oxo-2-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1H-pyrimidin-5-yl]carbamate Traditional Name: N-[6-keto-2-[3-[3-(piperidinomethyl)phenoxy]propylamino]-1H-pyrimidin-5-yl]carbamic acid ethyl ester Formula: C22H31N5O4 MolecularWeight: 429.51264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CN=C(NC1=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CCOC(=O)NC1=CN=C(NC1=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C22H31N5O4/c1-2-30-22(29)25-19-15-24-21(26-20(19)28)23-10-7-13-31-18-9-6-8-17(14-18)16-27-11-4-3-5-12-27/h6,8-9,14-15H,2-5,7,10-13,16H2,1H3,(H,25,29)(H2,23,24,26,28)