3,4-dihydro-1H-isoquinolin-2-yl-[1-[3-(phenylsulfonylmethyl)furan-2-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[1-[3-(phenylsulfonylmethyl)furan-2-yl]carbonylpiperidin-4-yl]methanone Openeye Name: [1-[3-(benzenesulfonylmethyl)furan-2-carbonyl]-4-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-[[3-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]-4-piperidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-[3-(benzenesulfonylmethyl)furan-2-carbonyl]piperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-[3-(besylmethyl)-2-furoyl]-4-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)C(=O)C4=C(C=CO4)CS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)C(=O)C4=C(C=CO4)CS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H28N2O5S/c30-26(29-16-10-20-6-4-5-7-22(20)18-29)21-11-14-28(15-12-21)27(31)25-23(13-17-34-25)19-35(32,33)24-8-2-1-3-9-24/h1-9,13,17,21H,10-12,14-16,18-19H2