methyl 4-[[methyl-(1-thiophen-2-ylcarbonylpyrrolidin-2-yl)carbonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-(1-thiophen-2-ylcarbonylpyrrolidin-2-yl)carbonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[methyl-[1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]methyl]benzoate CAS Name: 4-[[methyl-[oxo-[1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-[1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[methyl-[1-(2-thenoyl)prolyl]amino]methyl]benzoic acid methyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2CCCN2C(=O)C3=CC=CS3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2CCCN2C(=O)C3=CC=CS3

InChI

InChI=1S/C20H22N2O4S/c1-21(13-14-7-9-15(10-8-14)20(25)26-2)18(23)16-5-3-11-22(16)19(24)17-6-4-12-27-17/h4,6-10,12,16H,3,5,11,13H2,1-2H3