[2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate

Systemtic Name: [2-[(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate Openeye Name: [2-[4-methoxy-3-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate CAS Name: 2-[methyl(2-pyrimidinyl)amino]acetic acid [2-[4-methoxy-3-(1-piperidinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate Traditional Name: 2-[methyl(2-pyrimidyl)amino]acetic acid [2-keto-2-(4-methoxy-3-piperidinosulfonyl-anilino)ethyl] ester Formula: C21H27N5O6S MolecularWeight: 477.53398

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OCC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)C3=NC=CC=N3

Isomeric SMILES

CN(CC(=O)OCC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)C3=NC=CC=N3

InChI

InChI=1S/C21H27N5O6S/c1-25(21-22-9-6-10-23-21)14-20(28)32-15-19(27)24-16-7-8-17(31-2)18(13-16)33(29,30)26-11-4-3-5-12-26/h6-10,13H,3-5,11-12,14-15H2,1-2H3,(H,24,27)