[2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate

Systemtic Name: [2-oxidanylidene-2-[(3-pyrrolidin-1-ylsulfonylphenyl)amino]ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate Openeye Name: [2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate CAS Name: 2-[methyl(2-pyrimidinyl)amino]acetic acid [2-oxo-2-[3-(1-pyrrolidinylsulfonyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(3-pyrrolidin-1-ylsulfonylanilino)ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate Traditional Name: 2-[methyl(2-pyrimidyl)amino]acetic acid [2-keto-2-(3-pyrrolidinosulfonylanilino)ethyl] ester Formula: C19H23N5O5S MolecularWeight: 433.48142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=NC=CC=N3

Isomeric SMILES

CN(CC(=O)OCC(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCC2)C3=NC=CC=N3

InChI

InChI=1S/C19H23N5O5S/c1-23(19-20-8-5-9-21-19)13-18(26)29-14-17(25)22-15-6-4-7-16(12-15)30(27,28)24-10-2-3-11-24/h4-9,12H,2-3,10-11,13-14H2,1H3,(H,22,25)