3-[methyl(phenylsulfonylamino)amino]propanoyl 4-[2-(pyrimidin-2-ylamino)ethoxy]benzoate

Systemtic Name: 3-[methyl(phenylsulfonylamino)amino]propanoyl 4-[2-(pyrimidin-2-ylamino)ethoxy]benzoate Openeye Name: 3-[benzenesulfonamido(methyl)amino]propanoyl 4-[2-(pyrimidin-2-ylamino)ethoxy]benzoate CAS Name: 4-[2-(2-pyrimidinylamino)ethoxy]benzoic acid [3-[benzenesulfonamido(methyl)amino]-1-oxopropyl] ester IUPAC Name: 3-[benzenesulfonamido(methyl)amino]propanoyl 4-[2-(pyrimidin-2-ylamino)ethoxy]benzoate Traditional Name: 4-[2-(2-pyrimidylamino)ethoxy]benzoic acid 3-[benzenesulfonamido(methyl)amino]propanoyl ester Formula: C23H25N5O6S MolecularWeight: 499.5395

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)OC(=O)C1=CC=C(C=C1)OCCNC2=NC=CC=N2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CCC(=O)OC(=O)C1=CC=C(C=C1)OCCNC2=NC=CC=N2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25N5O6S/c1-28(27-35(31,32)20-6-3-2-4-7-20)16-12-21(29)34-22(30)18-8-10-19(11-9-18)33-17-15-26-23-24-13-5-14-25-23/h2-11,13-14,27H,12,15-17H2,1H3,(H,24,25,26)