dimethyl 2-[2-[2-azanyl-4-oxidanylidene-5-(5-oxidanyl-4-phenyl-pentyl)-1H-pyrimidin-6-yl]hydrazinyl]pentanedioate

Systemtic Name: dimethyl 2-[2-[2-azanyl-4-oxidanylidene-5-(5-oxidanyl-4-phenyl-pentyl)-1H-pyrimidin-6-yl]hydrazinyl]pentanedioate Openeye Name: dimethyl 2-[2-[2-amino-5-(5-hydroxy-4-phenyl-pentyl)-4-oxo-1H-pyrimidin-6-yl]hydrazino]pentanedioate CAS Name: 2-[[2-amino-5-(5-hydroxy-4-phenylpentyl)-4-oxo-1H-pyrimidin-6-yl]hydrazo]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[2-[2-amino-5-(5-hydroxy-4-phenylpentyl)-4-oxo-1H-pyrimidin-6-yl]hydrazinyl]pentanedioate Traditional Name: 2-[N'-[2-amino-5-(5-hydroxy-4-phenyl-pentyl)-4-keto-1H-pyrimidin-6-yl]hydrazino]glutaric acid dimethyl ester Formula: C22H31N5O6 MolecularWeight: 461.51144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)OC)NNC1=C(C(=O)N=C(N1)N)CCCC(CO)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(C(=O)OC)NNC1=C(C(=O)N=C(N1)N)CCCC(CO)C2=CC=CC=C2

InChI

InChI=1S/C22H31N5O6/c1-32-18(29)12-11-17(21(31)33-2)26-27-19-16(20(30)25-22(23)24-19)10-6-9-15(13-28)14-7-4-3-5-8-14/h3-5,7-8,15,17,26,28H,6,9-13H2,1-2H3,(H4,23,24,25,27,30)