ethyl 4-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(1-thiophen-2-ylsulfonylpyrrolidin-2-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[[1-(2-thienylsulfonyl)pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 4-[[oxo-(1-thiophen-2-ylsulfonyl-2-pyrrolidinyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-thiophen-2-ylsulfonylpyrrolidine-2-carbonyl)amino]benzoate Traditional Name: 4-[[1-(2-thienylsulfonyl)prolyl]amino]benzoic acid ethyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H20N2O5S2/c1-2-25-18(22)13-7-9-14(10-8-13)19-17(21)15-5-3-11-20(15)27(23,24)16-6-4-12-26-16/h4,6-10,12,15H,2-3,5,11H2,1H3,(H,19,21)