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

Systemtic Name: methyl 4-[2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[allyl(2-thienylsulfonyl)amino]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[prop-2-enyl(thiophen-2-ylsulfonyl)amino]acetyl]amino]benzoate Traditional Name: 4-[[2-[allyl(2-thienylsulfonyl)amino]acetyl]amino]benzoic acid methyl ester Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC=C)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CN(CC=C)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C17H18N2O5S2/c1-3-10-19(26(22,23)16-5-4-11-25-16)12-15(20)18-14-8-6-13(7-9-14)17(21)24-2/h3-9,11H,1,10,12H2,2H3,(H,18,20)