[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: [2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: [2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: 2-[(2-fluorophenyl)sulfonylamino]-3-phenylpropanoic acid [2-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 2-[(2-fluorophenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: 2-[(2-fluorophenyl)sulfonylamino]-3-phenyl-propionic acid [2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C26H27FN2O5S MolecularWeight: 498.566383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)COC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4F

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)COC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CC=C4F

InChI

InChI=1S/C26H27FN2O5S/c1-17-14-21(18(2)29(17)20-12-13-20)24(30)16-34-26(31)23(15-19-8-4-3-5-9-19)28-35(32,33)25-11-7-6-10-22(25)27/h3-11,14,20,23,28H,12-13,15-16H2,1-2H3