N-(2-azanylethyl)-7-(3-fluorophenyl)isoquinoline-5-sulfonamide

Systemtic Name: N-(2-azanylethyl)-7-(3-fluorophenyl)isoquinoline-5-sulfonamide Openeye Name: N-(2-aminoethyl)-7-(3-fluorophenyl)isoquinoline-5-sulfonamide CAS Name: N-(2-aminoethyl)-7-(3-fluorophenyl)-5-isoquinolinesulfonamide IUPAC Name: N-(2-aminoethyl)-7-(3-fluorophenyl)isoquinoline-5-sulfonamide Traditional Name: N-(2-aminoethyl)-7-(3-fluorophenyl)isoquinoline-5-sulfonamide Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C2=CC(=C3C=CN=CC3=C2)S(=O)(=O)NCCN

Isomeric SMILES

C1=CC(=CC(=C1)F)C2=CC(=C3C=CN=CC3=C2)S(=O)(=O)NCCN

InChI

InChI=1S/C17H16FN3O2S/c18-15-3-1-2-12(9-15)13-8-14-11-20-6-4-16(14)17(10-13)24(22,23)21-7-5-19/h1-4,6,8-11,21H,5,7,19H2