N-[(3,5-dimethylphenyl)methyl]isoquinoline-5-sulfonamide

Systemtic Name: N-[(3,5-dimethylphenyl)methyl]isoquinoline-5-sulfonamide Openeye Name: N-[(3,5-dimethylphenyl)methyl]isoquinoline-5-sulfonamide CAS Name: N-[(3,5-dimethylphenyl)methyl]-5-isoquinolinesulfonamide IUPAC Name: N-[(3,5-dimethylphenyl)methyl]isoquinoline-5-sulfonamide Traditional Name: N-(3,5-dimethylbenzyl)isoquinoline-5-sulfonamide Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)CNS(=O)(=O)C2=CC=CC3=C2C=CN=C3)C

InChI

InChI=1S/C18H18N2O2S/c1-13-8-14(2)10-15(9-13)11-20-23(21,22)18-5-3-4-16-12-19-7-6-17(16)18/h3-10,12,20H,11H2,1-2H3