ethyl 2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]thiophene-3-carboxylate CAS Name: 2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 4-phenyl-2-[(1-tosylprolyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCCN3S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C25H26N2O5S2/c1-3-32-25(29)22-20(18-8-5-4-6-9-18)16-33-24(22)26-23(28)21-10-7-15-27(21)34(30,31)19-13-11-17(2)12-14-19/h4-6,8-9,11-14,16,21H,3,7,10,15H2,1-2H3,(H,26,28)