[2-[(4-methoxyphenyl)-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 3-(methylsulfonylamino)benzoate

Systemtic Name: [2-[(4-methoxyphenyl)-(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 3-(methylsulfonylamino)benzoate Openeye Name: [2-[4-methoxy-N-(2-thienylmethyl)anilino]-2-oxo-ethyl] 3-(methanesulfonamido)benzoate CAS Name: 3-(methanesulfonamido)benzoic acid [2-[4-methoxy-N-(thiophen-2-ylmethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-methoxy-N-(thiophen-2-ylmethyl)anilino]-2-oxoethyl] 3-(methanesulfonamido)benzoate Traditional Name: 3-(methanesulfonamido)benzoic acid [2-keto-2-[4-methoxy-N-(2-thenyl)anilino]ethyl] ester Formula: C22H22N2O6S2 MolecularWeight: 474.54988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)N(CC2=CC=CS2)C(=O)COC(=O)C3=CC(=CC=C3)NS(=O)(=O)C

InChI

InChI=1S/C22H22N2O6S2/c1-29-19-10-8-18(9-11-19)24(14-20-7-4-12-31-20)21(25)15-30-22(26)16-5-3-6-17(13-16)23-32(2,27)28/h3-13,23H,14-15H2,1-2H3