dimethyl 5-[[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(2S)-1-(2-thenoyl)prolyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H20N2O6S MolecularWeight: 416.4476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2CCCN2C(=O)C3=CC=CS3)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)[C@@H]2CCCN2C(=O)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C20H20N2O6S/c1-27-19(25)12-9-13(20(26)28-2)11-14(10-12)21-17(23)15-5-3-7-22(15)18(24)16-6-4-8-29-16/h4,6,8-11,15H,3,5,7H2,1-2H3,(H,21,23)/t15-/m0/s1