3,4-dihydro-1H-isoquinolin-2-yl-[5-[(4-methylphenyl)sulfonylmethyl]furan-2-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(4-methylphenyl)sulfonylmethyl]furan-2-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(p-tolylsulfonylmethyl)-2-furyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(4-methylphenyl)sulfonylmethyl]-2-furanyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-[(4-methylphenyl)sulfonylmethyl]furan-2-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[5-(tosylmethyl)-2-furyl]methanone Formula: C22H21NO4S MolecularWeight: 395.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CC=C(O2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H21NO4S/c1-16-6-9-20(10-7-16)28(25,26)15-19-8-11-21(27-19)22(24)23-13-12-17-4-2-3-5-18(17)14-23/h2-11H,12-15H2,1H3