dimethyl 5-[2-(3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(3,5-dimethyl-4-morpholin-4-ylsulfonyl-pyrazol-1-yl)ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[3,5-dimethyl-4-(4-morpholinylsulfonyl)-1-pyrazolyl]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(3,5-dimethyl-4-morpholin-4-ylsulfonylpyrazol-1-yl)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(3,5-dimethyl-4-morpholinosulfonyl-pyrazol-1-yl)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H26N4O8S MolecularWeight: 494.51814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H26N4O8S/c1-13-19(34(29,30)24-5-7-33-8-6-24)14(2)25(23-13)12-18(26)22-17-10-15(20(27)31-3)9-16(11-17)21(28)32-4/h9-11H,5-8,12H2,1-4H3,(H,22,26)