methyl 4-[[[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[(2S)-1-thiophen-2-ylcarbonylpyrrolidin-2-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[(2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[(2S)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[(2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[(2S)-1-(2-thenoyl)prolyl]amino]methyl]benzoic acid methyl ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2CCCN2C(=O)C3=CC=CS3

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-25-19(24)14-8-6-13(7-9-14)12-20-17(22)15-4-2-10-21(15)18(23)16-5-3-11-26-16/h3,5-9,11,15H,2,4,10,12H2,1H3,(H,20,22)/t15-/m0/s1