[4-(thiophen-2-ylcarbonylamino)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate

Systemtic Name: [4-(thiophen-2-ylcarbonylamino)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate Openeye Name: [4-(thiophene-2-carbonylamino)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate CAS Name: 3-(1-pyrrolidinylsulfonyl)benzoic acid [4-[[oxo(thiophen-2-yl)methyl]amino]phenyl] ester IUPAC Name: [4-(thiophene-2-carbonylamino)phenyl] 3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 3-pyrrolidinosulfonylbenzoic acid [4-(2-thenoylamino)phenyl] ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H20N2O5S2/c25-21(20-7-4-14-30-20)23-17-8-10-18(11-9-17)29-22(26)16-5-3-6-19(15-16)31(27,28)24-12-1-2-13-24/h3-11,14-15H,1-2,12-13H2,(H,23,25)