butyl 4-[[2,5-dimethyl-1-(phenylsulfonyl)pyrrol-3-yl]sulfonylamino]benzoate

Systemtic Name: butyl 4-[[2,5-dimethyl-1-(phenylsulfonyl)pyrrol-3-yl]sulfonylamino]benzoate Openeye Name: butyl 4-[[1-(benzenesulfonyl)-2,5-dimethyl-pyrrol-3-yl]sulfonylamino]benzoate CAS Name: 4-[[1-(benzenesulfonyl)-2,5-dimethyl-3-pyrrolyl]sulfonylamino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(benzenesulfonyl)-2,5-dimethylpyrrol-3-yl]sulfonylamino]benzoate Traditional Name: 4-[(1-besyl-2,5-dimethyl-pyrrol-3-yl)sulfonylamino]benzoic acid butyl ester Formula: C23H26N2O6S2 MolecularWeight: 490.59234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(N(C(=C2)C)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(N(C(=C2)C)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H26N2O6S2/c1-4-5-15-31-23(26)19-11-13-20(14-12-19)24-32(27,28)22-16-17(2)25(18(22)3)33(29,30)21-9-7-6-8-10-21/h6-14,16,24H,4-5,15H2,1-3H3