N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[[1-(2-furylmethyl)-4-piperidyl]methyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[[1-(2-furanylmethyl)-4-piperidinyl]methyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[[1-(furan-2-ylmethyl)piperidin-4-yl]methyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[[1-(2-furfuryl)-4-piperidyl]methyl]-4-pyrrolidinosulfonyl-benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3CCN(CC3)CC4=CC=CO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3CCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C22H29N3O4S/c26-22(19-5-7-21(8-6-19)30(27,28)25-11-1-2-12-25)23-16-18-9-13-24(14-10-18)17-20-4-3-15-29-20/h3-8,15,18H,1-2,9-14,16-17H2,(H,23,26)