(3-morpholin-4-ylsulfonylphenyl)methyl 2-[methyl(pyrimidin-2-yl)amino]ethanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-[methyl(pyrimidin-2-yl)amino]ethanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 2-[methyl(pyrimidin-2-yl)amino]acetate CAS Name: 2-[methyl(2-pyrimidinyl)amino]acetic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 2-[methyl(pyrimidin-2-yl)amino]acetate Traditional Name: 2-[methyl(2-pyrimidyl)amino]acetic acid (3-morpholinosulfonylbenzyl) ester Formula: C18H22N4O5S MolecularWeight: 406.45608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)C3=NC=CC=N3

Isomeric SMILES

CN(CC(=O)OCC1=CC(=CC=C1)S(=O)(=O)N2CCOCC2)C3=NC=CC=N3

InChI

InChI=1S/C18H22N4O5S/c1-21(18-19-6-3-7-20-18)13-17(23)27-14-15-4-2-5-16(12-15)28(24,25)22-8-10-26-11-9-22/h2-7,12H,8-11,13-14H2,1H3