N-(1-adamantyl)-3-(fluoranylmethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide

Systemtic Name: N-(1-adamantyl)-3-(fluoranylmethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Openeye Name: N-(1-adamantyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide CAS Name: N-(1-adamantyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide IUPAC Name: N-(1-adamantyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Traditional Name: N-(1-adamantyl)-3-(fluoromethyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide Formula: C20H27FN2O2S MolecularWeight: 378.503983

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC5=C(CC(NC5)CF)C=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC5=C(CC(NC5)CF)C=C4

InChI

InChI=1S/C20H27FN2O2S/c21-11-18-6-16-1-2-19(7-17(16)12-22-18)26(24,25)23-20-8-13-3-14(9-20)5-15(4-13)10-20/h1-2,7,13-15,18,22-23H,3-6,8-12H2