3-(2-methylsulfonylethyl)-1-(phenylmethyl)isoquinoline

Systemtic Name: 3-(2-methylsulfonylethyl)-1-(phenylmethyl)isoquinoline Openeye Name: 1-benzyl-3-(2-methylsulfonylethyl)isoquinoline CAS Name: 3-(2-methylsulfonylethyl)-1-(phenylmethyl)isoquinoline IUPAC Name: 1-benzyl-3-(2-methylsulfonylethyl)isoquinoline Traditional Name: 1-benzyl-3-(2-mesylethyl)isoquinoline Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC1=CC2=CC=CC=C2C(=N1)CC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)CCC1=CC2=CC=CC=C2C(=N1)CC3=CC=CC=C3

InChI

InChI=1S/C19H19NO2S/c1-23(21,22)12-11-17-14-16-9-5-6-10-18(16)19(20-17)13-15-7-3-2-4-8-15/h2-10,14H,11-13H2,1H3