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

Systemtic Name: ethyl 2-[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[2-[3-(p-tolylsulfonyl)propanoyloxy]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[3-(4-methylphenyl)sulfonyl-1-oxopropoxy]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(4-methylphenyl)sulfonylpropanoyloxy]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 4-phenyl-2-[[2-(3-tosylpropanoyloxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H25NO7S2 MolecularWeight: 515.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)CCS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H25NO7S2/c1-3-32-25(29)23-20(18-7-5-4-6-8-18)16-34-24(23)26-21(27)15-33-22(28)13-14-35(30,31)19-11-9-17(2)10-12-19/h4-12,16H,3,13-15H2,1-2H3,(H,26,27)