N-[[3-(furan-2-ylcarbonylamino)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[[3-(furan-2-ylcarbonylamino)phenyl]methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[[3-(furan-2-carbonylamino)phenyl]methyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[[3-[[2-furanyl(oxo)methyl]amino]phenyl]methyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[[3-(furan-2-carbonylamino)phenyl]methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(2-furoylamino)benzyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C22H23N3O5S2 MolecularWeight: 473.56512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCC3=CC(=CC=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H23N3O5S2/c26-21(17-6-2-10-25(15-17)32(28,29)20-9-4-12-31-20)23-14-16-5-1-7-18(13-16)24-22(27)19-8-3-11-30-19/h1,3-5,7-9,11-13,17H,2,6,10,14-15H2,(H,23,26)(H,24,27)