N-butyl-N-phenyl-isoquinoline-5-sulfonamide

Systemtic Name: N-butyl-N-phenyl-isoquinoline-5-sulfonamide Openeye Name: N-butyl-N-phenyl-isoquinoline-5-sulfonamide CAS Name: N-butyl-N-phenyl-5-isoquinolinesulfonamide IUPAC Name: N-butyl-N-phenylisoquinoline-5-sulfonamide Traditional Name: N-butyl-N-phenyl-isoquinoline-5-sulfonamide Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

Isomeric SMILES

CCCCN(C1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C19H20N2O2S/c1-2-3-14-21(17-9-5-4-6-10-17)24(22,23)19-11-7-8-16-15-20-13-12-18(16)19/h4-13,15H,2-3,14H2,1H3