N-(2-diethylaminoethyl)-N-methyl-isoquinoline-5-sulfonamide

Systemtic Name: N-(2-diethylaminoethyl)-N-methyl-isoquinoline-5-sulfonamide Openeye Name: N-(2-diethylaminoethyl)-N-methyl-isoquinoline-5-sulfonamide CAS Name: N-(2-diethylaminoethyl)-N-methyl-5-isoquinolinesulfonamide IUPAC Name: N-(2-diethylaminoethyl)-N-methylisoquinoline-5-sulfonamide Traditional Name: N-(2-diethylaminoethyl)-N-methyl-isoquinoline-5-sulfonamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCN(CC)CCN(C)S(=O)(=O)C1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C16H23N3O2S/c1-4-19(5-2)12-11-18(3)22(20,21)16-8-6-7-14-13-17-10-9-15(14)16/h6-10,13H,4-5,11-12H2,1-3H3