N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-(furan-2-ylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-(furan-2-ylcarbonyl)piperidine-4-carboxamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-1-[2-furanyl(oxo)methyl]-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-1-(2-furoyl)isonipecotamide Formula: C21H24ClN3O5S MolecularWeight: 465.95036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CO4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CO4)Cl

InChI

InChI=1S/C21H24ClN3O5S/c22-17-6-5-16(14-19(17)31(28,29)25-9-1-2-10-25)23-20(26)15-7-11-24(12-8-15)21(27)18-4-3-13-30-18/h3-6,13-15H,1-2,7-12H2,(H,23,26)