methyl 4-[[2-[[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]amino]-2-oxidanylidene-ethanoyl]amino]benzoate

Systemtic Name: methyl 4-[[2-[[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-yl-ethyl]amino]-2-oxidanylidene-ethanoyl]amino]benzoate Openeye Name: methyl 4-[[2-[[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]amino]-2-oxo-acetyl]amino]benzoate CAS Name: 4-[[2-[[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]amino]-1,2-dioxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[[2-(4-methoxyphenyl)sulfonyl-2-thiophen-2-ylethyl]amino]-2-oxoacetyl]amino]benzoate Traditional Name: 4-[[2-keto-2-[[2-(4-methoxyphenyl)sulfonyl-2-(2-thienyl)ethyl]amino]acetyl]amino]benzoic acid methyl ester Formula: C23H22N2O7S2 MolecularWeight: 502.55998

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C(=O)NC2=CC=C(C=C2)C(=O)OC)C3=CC=CS3

InChI

InChI=1S/C23H22N2O7S2/c1-31-17-9-11-18(12-10-17)34(29,30)20(19-4-3-13-33-19)14-24-21(26)22(27)25-16-7-5-15(6-8-16)23(28)32-2/h3-13,20H,14H2,1-2H3,(H,24,26)(H,25,27)