methyl 3-phenyl-2-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-phenyl-2-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]propanoate Openeye Name: methyl 3-phenyl-2-[[1-(2-thienylsulfonyl)pyrrolidine-2-carbonyl]amino]propanoate CAS Name: 2-[[oxo-(1-thiophen-2-ylsulfonyl-2-pyrrolidinyl)methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-phenyl-2-[(1-thiophen-2-ylsulfonylpyrrolidine-2-carbonyl)amino]propanoate Traditional Name: 3-phenyl-2-[[1-(2-thienylsulfonyl)prolyl]amino]propionic acid methyl ester Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H22N2O5S2/c1-26-19(23)15(13-14-7-3-2-4-8-14)20-18(22)16-9-5-11-21(16)28(24,25)17-10-6-12-27-17/h2-4,6-8,10,12,15-16H,5,9,11,13H2,1H3,(H,20,22)