[1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-1-oxidanylidene-propan-2-yl] 4-[(5-chloranylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [1-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-1-oxidanylidene-propan-2-yl] 4-[(5-chloranylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-1-methyl-2-oxo-ethyl] 4-[(5-chloro-2-thienyl)sulfonylamino]benzoate CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonylamino]benzoic acid [1-(2,5-dimethyl-1-phenyl-3-pyrrolyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-1-oxopropan-2-yl] 4-[(5-chlorothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 4-[(5-chloro-2-thienyl)sulfonylamino]benzoic acid [2-(2,5-dimethyl-1-phenyl-pyrrol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C26H23ClN2O5S2 MolecularWeight: 543.05422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)C(C)OC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)C(C)OC(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C26H23ClN2O5S2/c1-16-15-22(17(2)29(16)21-7-5-4-6-8-21)25(30)18(3)34-26(31)19-9-11-20(12-10-19)28-36(32,33)24-14-13-23(27)35-24/h4-15,18,28H,1-3H3