ethyl 2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]propanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]propanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 5-phenyl-2-[2-[3-(p-tolylsulfonyl)propanoyloxy]propanoylamino]thiophene-3-carboxylate CAS Name: 2-[[2-[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]-1-oxopropyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]propanoylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 5-phenyl-2-[2-(3-tosylpropanoyloxy)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C26H27NO7S2 MolecularWeight: 529.62508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)C(C)OC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H27NO7S2/c1-4-33-26(30)21-16-22(19-8-6-5-7-9-19)35-25(21)27-24(29)18(3)34-23(28)14-15-36(31,32)20-12-10-17(2)11-13-20/h5-13,16,18H,4,14-15H2,1-3H3,(H,27,29)