methyl 5-[2-[(3,4-dimethoxyphenyl)sulfonyl-(4-methoxyphenyl)amino]ethanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[2-[(3,4-dimethoxyphenyl)sulfonyl-(4-methoxyphenyl)amino]ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-methoxy-anilino)acetyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-methoxyanilino)-1-oxoethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-methoxyanilino)acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-4-methoxy-anilino)acetyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C27H26N2O8S2 MolecularWeight: 570.63394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N(CC(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N(CC(=O)NC2=CC3=C(C=C2)SC(=C3)C(=O)OC)S(=O)(=O)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H26N2O8S2/c1-34-20-8-6-19(7-9-20)29(39(32,33)21-10-11-22(35-2)23(15-21)36-3)16-26(30)28-18-5-12-24-17(13-18)14-25(38-24)27(31)37-4/h5-15H,16H2,1-4H3,(H,28,30)