[2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate

Systemtic Name: [2-[(3-morpholin-4-ylsulfonylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate Openeye Name: [2-(3-morpholinosulfonylanilino)-2-oxo-1-phenyl-ethyl] 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-phenyl-3-pyrrolecarboxylic acid [2-[3-(4-morpholinylsulfonyl)anilino]-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3-morpholin-4-ylsulfonylanilino)-2-oxo-1-phenylethyl] 2,5-dimethyl-1-phenylpyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-phenyl-pyrrole-3-carboxylic acid [2-keto-2-(3-morpholinosulfonylanilino)-1-phenyl-ethyl] ester Formula: C31H31N3O6S MolecularWeight: 573.65934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OC(C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)OC(C3=CC=CC=C3)C(=O)NC4=CC(=CC=C4)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C31H31N3O6S/c1-22-20-28(23(2)34(22)26-13-7-4-8-14-26)31(36)40-29(24-10-5-3-6-11-24)30(35)32-25-12-9-15-27(21-25)41(37,38)33-16-18-39-19-17-33/h3-15,20-21,29H,16-19H2,1-2H3,(H,32,35)