methyl 4-[2-[2-[methyl(thiophen-2-ylsulfonyl)amino]ethanoylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[2-[methyl(thiophen-2-ylsulfonyl)amino]ethanoylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-[methyl(2-thienylsulfonyl)amino]acetyl]amino]ethyl]benzoate CAS Name: 4-[2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]-1-oxoethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-[methyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-[methyl(2-thienylsulfonyl)amino]acetyl]amino]ethyl]benzoic acid methyl ester Formula: C17H20N2O5S2 MolecularWeight: 396.4811

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCCC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CN(CC(=O)NCCC1=CC=C(C=C1)C(=O)OC)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H20N2O5S2/c1-19(26(22,23)16-4-3-11-25-16)12-15(20)18-10-9-13-5-7-14(8-6-13)17(21)24-2/h3-8,11H,9-10,12H2,1-2H3,(H,18,20)