N-cyclopropyl-N-[1-[2-(trifluoromethyloxy)phenyl]carbonylpiperidin-4-yl]isoquinoline-5-sulfonamide

Systemtic Name: N-cyclopropyl-N-[1-[2-(trifluoromethyloxy)phenyl]carbonylpiperidin-4-yl]isoquinoline-5-sulfonamide Openeye Name: N-cyclopropyl-N-[1-[2-(trifluoromethoxy)benzoyl]-4-piperidyl]isoquinoline-5-sulfonamide CAS Name: N-cyclopropyl-N-[1-[oxo-[2-(trifluoromethoxy)phenyl]methyl]-4-piperidinyl]-5-isoquinolinesulfonamide IUPAC Name: N-cyclopropyl-N-[1-[2-(trifluoromethoxy)benzoyl]piperidin-4-yl]isoquinoline-5-sulfonamide Traditional Name: N-cyclopropyl-N-[1-[2-(trifluoromethoxy)benzoyl]-4-piperidyl]isoquinoline-5-sulfonamide Formula: C25H24F3N3O4S MolecularWeight: 519.53597

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCN(CC2)C(=O)C3=CC=CC=C3OC(F)(F)F)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

Isomeric SMILES

C1CC1N(C2CCN(CC2)C(=O)C3=CC=CC=C3OC(F)(F)F)S(=O)(=O)C4=CC=CC5=C4C=CN=C5

InChI

InChI=1S/C25H24F3N3O4S/c26-25(27,28)35-22-6-2-1-5-21(22)24(32)30-14-11-19(12-15-30)31(18-8-9-18)36(33,34)23-7-3-4-17-16-29-13-10-20(17)23/h1-7,10,13,16,18-19H,8-9,11-12,14-15H2